3-(2-methylphenyl)-2-[2-[4-(4-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methylphenyl)-2-[2-[4-(4-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(o-tolyl)-2-[2-oxo-2-[4-(p-tolyl)piperazin-1-yl]ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methylphenyl)-2-[[2-[4-(4-methylphenyl)-1-piperazinyl]-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methylphenyl)-2-[2-[4-(4-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 2-[[2-keto-2-[4-(p-tolyl)piperazino]ethyl]thio]-3-(o-tolyl)quinazolin-4-one Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5C

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5C

InChI

InChI=1S/C28H28N4O2S/c1-20-11-13-22(14-12-20)30-15-17-31(18-16-30)26(33)19-35-28-29-24-9-5-4-8-23(24)27(34)32(28)25-10-6-3-7-21(25)2/h3-14H,15-19H2,1-2H3