3-(azepan-1-ylcarbonyl)-5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-(2-methylpropyl)pyridin-4-one

Systemtic Name: 3-(azepan-1-ylcarbonyl)-5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-(2-methylpropyl)pyridin-4-one Openeye Name: 3-(azepane-1-carbonyl)-5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-isobutyl-pyridin-4-one CAS Name: 3-[1-azepanyl(oxo)methyl]-5-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-(2-methylpropyl)-4-pyridinone IUPAC Name: 3-(azepane-1-carbonyl)-5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-(2-methylpropyl)pyridin-4-one Traditional Name: 3-(azepane-1-carbonyl)-5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-isobutyl-4-pyridone Formula: C27H35ClN4O3 MolecularWeight: 499.0448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)N4CCCCCC4

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)N4CCCCCC4

InChI

InChI=1S/C27H35ClN4O3/c1-20(2)17-29-18-23(26(34)31-10-5-3-4-6-11-31)25(33)24(19-29)27(35)32-14-12-30(13-15-32)22-9-7-8-21(28)16-22/h7-9,16,18-20H,3-6,10-15,17H2,1-2H3