ethyl 3-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methylsulfanylcarbothioyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 3-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methylsulfanylcarbothioyl]-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 3-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methylsulfanylcarbothioyl]thiazolidine-4-carboxylate CAS Name: 3-[[(2-methyl-4-oxo-1H-quinazolin-6-yl)methylthio]-sulfanylidenemethyl]-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methylsulfanylcarbothioyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-[(4-keto-2-methyl-1H-quinazolin-6-yl)methylthio]carbothioylthiazolidine-4-carboxylic acid ethyl ester Formula: C17H19N3O3S3 MolecularWeight: 409.54606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCN1C(=S)SCC2=CC3=C(C=C2)NC(=NC3=O)C

Isomeric SMILES

CCOC(=O)C1CSCN1C(=S)SCC2=CC3=C(C=C2)NC(=NC3=O)C

InChI

InChI=1S/C17H19N3O3S3/c1-3-23-16(22)14-8-25-9-20(14)17(24)26-7-11-4-5-13-12(6-11)15(21)19-10(2)18-13/h4-6,14H,3,7-9H2,1-2H3,(H,18,19,21)