2-[[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-3-methyl-quinazolin-4-one

Systemtic Name: 2-[[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-3-methyl-quinazolin-4-one Openeye Name: 2-[[3-(2-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-3-methyl-quinazolin-4-one CAS Name: 2-[[[3-(2-ethylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-3-methyl-4-quinazolinone IUPAC Name: 2-[[3-(2-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-3-methylquinazolin-4-one Traditional Name: 2-[[[3-(2-ethylphenyl)-4-keto-quinazolin-2-yl]thio]methyl]-3-methyl-quinazolin-4-one Formula: C26H22N4O2S MolecularWeight: 454.54348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5C(=O)N4C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5C(=O)N4C

InChI

InChI=1S/C26H22N4O2S/c1-3-17-10-4-9-15-22(17)30-25(32)19-12-6-8-14-21(19)28-26(30)33-16-23-27-20-13-7-5-11-18(20)24(31)29(23)2/h4-15H,3,16H2,1-2H3