ethyl 4-[(9-amino-7-sulfanylidene-2,3,5,8,10-pentazabicyclo[4.4.0]deca-2,4,8,11-tetraen-4-yl)methylamino]benzoate

Modify Date: 2025-08-28 23:28:13

ethyl 4-[(9-amino-7-sulfanylidene-2,3,5,8,10-pentazabicyclo[4.4.0]deca-2,4,8,11-tetraen-4-yl)methylamino]benzoate structure	Common Name	ethyl 4-[(9-amino-7-sulfanylidene-2,3,5,8,10-pentazabicyclo[4.4.0]deca-2,4,8,11-tetraen-4-yl)methylamino]benzoate
	CAS Number	35171-08-5	Molecular Weight	357.39000
	Density	1.58g/cm3	Boiling Point	672ºC at 760 mmHg
	Molecular Formula	C₁₅H₁₅N₇O₂S	Melting Point	N/A
	MSDS	N/A	Flash Point	360.2ºC

Name	ethyl 4-[(7-amino-5-sulfanylidene-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoate

Density	1.58g/cm3
Boiling Point	672ºC at 760 mmHg
Molecular Formula	C₁₅H₁₅N₇O₂S
Molecular Weight	357.39000
Flash Point	360.2ºC
Exact Mass	357.10100
PSA	163.79000
LogP	2.50260
Index of Refraction	1.771
InChIKey	BPOXSCWJHOLTHY-UHFFFAOYSA-N
SMILES	CCOC(=O)c1ccc(NCc2nnc3[nH]c(N)nc(=S)c3n2)cc1

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