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

Systemtic Name: methyl 2-[4-[4-oxidanylidene-2-(phenylmethylsulfanyl)quinazolin-3-yl]phenyl]ethanoate Openeye Name: methyl 2-[4-(2-benzylsulfanyl-4-oxo-quinazolin-3-yl)phenyl]acetate CAS Name: 2-[4-[4-oxo-2-(phenylmethylthio)-3-quinazolinyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-benzylsulfanyl-4-oxoquinazolin-3-yl)phenyl]acetate Traditional Name: 2-[4-[2-(benzylthio)-4-keto-quinazolin-3-yl]phenyl]acetic acid methyl ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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=C2SCC4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O3S/c1-29-22(27)15-17-11-13-19(14-12-17)26-23(28)20-9-5-6-10-21(20)25-24(26)30-16-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3