butyl 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: butyl 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: butyl 2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]acetic acid butyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N2O3S/c1-3-4-13-26-19(24)14-27-21-22-18-8-6-5-7-17(18)20(25)23(21)16-11-9-15(2)10-12-16/h5-12H,3-4,13-14H2,1-2H3