3-(2-methylphenyl)-2-(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methylphenyl)-2-(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(o-tolyl)-2-[2-oxo-1-phenyl-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methylphenyl)-2-[[2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methylphenyl)-2-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 2-[(2-keto-1-phenyl-2-piperidino-ethyl)thio]-3-(o-tolyl)quinazolin-4-one Formula: C28H27N3O2S MolecularWeight: 469.59788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC(C4=CC=CC=C4)C(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC(C4=CC=CC=C4)C(=O)N5CCCCC5

InChI

InChI=1S/C28H27N3O2S/c1-20-12-6-9-17-24(20)31-26(32)22-15-7-8-16-23(22)29-28(31)34-25(21-13-4-2-5-14-21)27(33)30-18-10-3-11-19-30/h2,4-9,12-17,25H,3,10-11,18-19H2,1H3