N-(cyclohexylmethyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-4-oxidanylidene-1-propan-2-yl-pyridine-3-carboxamide Openeye Name: N-(cyclohexylmethyl)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1-isopropyl-4-oxo-pyridine-3-carboxamide CAS Name: N-(cyclohexylmethyl)-5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-4-oxo-1-propan-2-yl-3-pyridinecarboxamide IUPAC Name: N-(cyclohexylmethyl)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-4-oxo-1-propan-2-ylpyridine-3-carboxamide Traditional Name: N-(cyclohexylmethyl)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1-isopropyl-4-keto-nicotinamide Formula: C29H40N4O3 MolecularWeight: 492.6529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NCC4CCCCC4)C(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NCC4CCCCC4)C(C)C)C

InChI

InChI=1S/C29H40N4O3/c1-20(2)33-18-24(28(35)30-17-23-10-6-5-7-11-23)27(34)25(19-33)29(36)32-15-13-31(14-16-32)26-12-8-9-21(3)22(26)4/h8-9,12,18-20,23H,5-7,10-11,13-17H2,1-4H3,(H,30,35)