ethyl 4-(5-methyl-7-oxidanylidene-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)benzoate

Systemtic Name: ethyl 4-(5-methyl-7-oxidanylidene-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)benzoate Openeye Name: ethyl 4-(5-methyl-7-oxo-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-3-yl)benzoate CAS Name: 4-(5-methyl-7-oxo-2-sulfanylidene-4H-thiazolo[4,5-d]pyrimidin-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-methyl-7-oxo-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)benzoate Traditional Name: 4-(7-keto-5-methyl-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-3-yl)benzoic acid ethyl ester Formula: C15H13N3O3S2 MolecularWeight: 347.41202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C3=C(C(=O)N=C(N3)C)SC2=S

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C3=C(C(=O)N=C(N3)C)SC2=S

InChI

InChI=1S/C15H13N3O3S2/c1-3-21-14(20)9-4-6-10(7-5-9)18-12-11(23-15(18)22)13(19)17-8(2)16-12/h4-7H,3H2,1-2H3,(H,16,17,19)