methyl 2-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]ethanoate Openeye Name: methyl 2-[4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)phenyl]acetate CAS Name: 2-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]acetate Traditional Name: 2-[4-(4-keto-2-thioxo-1H-quinazolin-3-yl)phenyl]acetic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O3S/c1-22-15(20)10-11-6-8-12(9-7-11)19-16(21)13-4-2-3-5-14(13)18-17(19)23/h2-9H,10H2,1H3,(H,18,23)