2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-phenylbutan-2-yl)ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-phenylbutan-2-yl)ethanamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(4-phenylbutan-2-yl)acetamide IUPAC Name: 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-phenylbutan-2-yl)acetamide Traditional Name: 2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]-N-(1-methyl-3-phenyl-propyl)acetamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-19-12-16-22(17-13-19)30-26(32)23-10-6-7-11-24(23)29-27(30)33-18-25(31)28-20(2)14-15-21-8-4-3-5-9-21/h3-13,16-17,20H,14-15,18H2,1-2H3,(H,28,31)