methyl 2-methylsulfanyl-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-methylsulfanyl-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate Openeye Name: methyl 2-methylsulfanyl-4-oxo-3-phenyl-quinazoline-7-carboxylate CAS Name: 2-(methylthio)-4-oxo-3-phenyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-methylsulfanyl-4-oxo-3-phenylquinazoline-7-carboxylate Traditional Name: 4-keto-2-(methylthio)-3-phenyl-quinazoline-7-carboxylic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SC)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SC)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O3S/c1-22-16(21)11-8-9-13-14(10-11)18-17(23-2)19(15(13)20)12-6-4-3-5-7-12/h3-10H,1-2H3