methyl 4-methyl-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzoate

Systemtic Name: methyl 4-methyl-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzoate Openeye Name: methyl 4-methyl-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzoate CAS Name: 4-methyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzoate Traditional Name: 3-(4-keto-2-thioxo-1H-quinazolin-3-yl)-4-methyl-benzoic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)N2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)N2C(=O)C3=CC=CC=C3NC2=S

InChI

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