(S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate
(S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate structure
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Common Name | (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate | ||
|---|---|---|---|---|
| CAS Number | 89604-91-1 | Molecular Weight | 351.42700 | |
| Density | 1.73 g/cm3 | Boiling Point | 565.2ºC at 760 mmHg | |
| Molecular Formula | C12H9N5O2S3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.73 g/cm3 |
|---|---|
| Boiling Point | 565.2ºC at 760 mmHg |
| Molecular Formula | C12H9N5O2S3 |
| Molecular Weight | 351.42700 |
| Exact Mass | 350.99200 |
| PSA | 184.08000 |
| LogP | 3.06810 |
| Index of Refraction | 1.842 |
| InChIKey | XJESSAAEFWMELV-PXNMLYILSA-N |
| SMILES | CON=C(C(=O)Sc1nc2ccccc2s1)c1nsc(N)n1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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(S)-2-Benzothia... CAS#:89604-91-1 |
| Literature: WO2010/89729 A1, ; Page/Page column 25 ; |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| DAMA |
| (Z)-S-benzo[d]thiazol-2-yl 2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)ethanethioate |
| S-(2-benzothiazolyl) (Z)-2-(2-amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)thioacetate |
| Diethyl thiophosphoryl (Z)-(2-amino-1,3-thiazol-4-yl)(methoxyimino)acetate |
| ZeaM |
| 2-Mercaptobenzothiazoyl(Z)-2-(2-amino-1,2,4-thiadiazol-4-yl)-2-methoxyiminothioacetate |
| ATDM |
| O,O-DIETHYLTHIOPHOSPHORYL (Z)-2-(2-AMINOTHIAZOL-4-YL)-2-METHOXYIMINOACETATE |
| ZAEM:S-2-BENZOTHIAZOLYL ( Z )-2-(5-AMINO-1,2,4-THIADIAZOL-3-YL)-2-METHOXYIMINO THIOACETATE |
| S-1,3-benzothiazol-2-yl (2Z)-(5-amino-1,2,4-thiadiazol-3-yl)(methoxyimino)ethanethioate |
| DIETHYL THIOPHOSPHORYL-(Z)-(2-AMINOTHIAZOL-4-YL)-(METHOXYIMINO)ACETATE |
| 1,2,4-Thiadiazole-3-ethanethioicacid,5-amino-a-(methoxyimino)-,S-2-benzothiazolyl ester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: InChIKey of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is XJESSAAEFWMELV-PXNMLYILSA-N. |
| Q: What is the SMILES notation of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: SMILES notation of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is CON=C(C(=O)Sc1nc2ccccc2s1)c1nsc(N)n1. |
| Q: What is the molecular formula of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: Molecular formula of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is C12H9N5O2S3. |
| Q: What is the English name of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: The English name of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate. |
| Q: What is the CAS number of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: CAS number of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is 89604-91-1. |
| Q: What is the LogP of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: LogP of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is 3.06810. |
| Q: What are the upstream materials of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: Related upstream materials(CAS) of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate: 120-78-5;72217-12-0. |
| Q: What is the polar surface area (PSA) of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: Polar surface area (PSA) of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is 184.08000. |
| Q: What is the boiling point of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: Boiling point of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is 565.2ºC at 760 mmHg. |
| Q: What is the molecular weight of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate? |
| A: Molecular weight of (S)-2-Benzothiazolyl (Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminothioacetate is 351.42700. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |