4-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-phenylbutan-2-yl)butanamide

Systemtic Name: 4-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-phenylbutan-2-yl)butanamide Openeye Name: 4-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-methyl-3-phenyl-propyl)butanamide CAS Name: 4-[[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(4-phenylbutan-2-yl)butanamide IUPAC Name: 4-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-phenylbutan-2-yl)butanamide Traditional Name: 4-[[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(1-methyl-3-phenyl-propyl)butyramide Formula: C28H28ClN3O2S MolecularWeight: 506.05882

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)CCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H28ClN3O2S/c1-20(16-17-21-9-3-2-4-10-21)30-26(33)15-8-18-35-28-31-25-14-6-5-13-24(25)27(34)32(28)23-12-7-11-22(29)19-23/h2-7,9-14,19-20H,8,15-18H2,1H3,(H,30,33)