N-(cyclohexylmethyl)-1-cyclopropyl-4-oxidanylidene-5-(4-phenylpiperazin-1-yl)carbonyl-pyridine-3-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-1-cyclopropyl-4-oxidanylidene-5-(4-phenylpiperazin-1-yl)carbonyl-pyridine-3-carboxamide Openeye Name: N-(cyclohexylmethyl)-1-cyclopropyl-4-oxo-5-(4-phenylpiperazine-1-carbonyl)pyridine-3-carboxamide CAS Name: N-(cyclohexylmethyl)-1-cyclopropyl-4-oxo-5-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-(cyclohexylmethyl)-1-cyclopropyl-4-oxo-5-(4-phenylpiperazine-1-carbonyl)pyridine-3-carboxamide Traditional Name: N-(cyclohexylmethyl)-1-cyclopropyl-4-keto-5-(4-phenylpiperazine-1-carbonyl)nicotinamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCN(CC3)C4=CC=CC=C4)C5CC5

Isomeric SMILES

C1CCC(CC1)CNC(=O)C2=CN(C=C(C2=O)C(=O)N3CCN(CC3)C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C27H34N4O3/c32-25-23(26(33)28-17-20-7-3-1-4-8-20)18-31(22-11-12-22)19-24(25)27(34)30-15-13-29(14-16-30)21-9-5-2-6-10-21/h2,5-6,9-10,18-20,22H,1,3-4,7-8,11-17H2,(H,28,33)