5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-4-oxidanylidene-1-(phenylmethyl)-N-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-4-oxidanylidene-1-(phenylmethyl)-N-propan-2-yl-pyridine-3-carboxamide Openeye Name: 1-benzyl-5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-N-isopropyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-4-oxo-1-(phenylmethyl)-N-propan-2-yl-3-pyridinecarboxamide IUPAC Name: 1-benzyl-5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-oxo-N-propan-2-ylpyridine-3-carboxamide Traditional Name: 1-benzyl-5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-N-isopropyl-4-keto-nicotinamide Formula: C27H29ClN4O3 MolecularWeight: 492.99716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C27H29ClN4O3/c1-19(2)29-26(34)23-17-30(16-20-7-4-3-5-8-20)18-24(25(23)33)27(35)32-13-11-31(12-14-32)22-10-6-9-21(28)15-22/h3-10,15,17-19H,11-14,16H2,1-2H3,(H,29,34)