methyl 2-[4-(2-methylsulfanyl-4-oxidanylidene-quinazolin-3-yl)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(2-methylsulfanyl-4-oxidanylidene-quinazolin-3-yl)phenyl]ethanoate Openeye Name: methyl 2-[4-(2-methylsulfanyl-4-oxo-quinazolin-3-yl)phenyl]acetate CAS Name: 2-[4-[2-(methylthio)-4-oxo-3-quinazolinyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-methylsulfanyl-4-oxoquinazolin-3-yl)phenyl]acetate Traditional Name: 2-[4-[4-keto-2-(methylthio)quinazolin-3-yl]phenyl]acetic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC

InChI

InChI=1S/C18H16N2O3S/c1-23-16(21)11-12-7-9-13(10-8-12)20-17(22)14-5-3-4-6-15(14)19-18(20)24-2/h3-10H,11H2,1-2H3