N-tert-butyl-1-cyclohexyl-4-oxidanylidene-5-(4-phenylpiperazin-1-yl)carbonyl-pyridine-3-carboxamide

Systemtic Name: N-tert-butyl-1-cyclohexyl-4-oxidanylidene-5-(4-phenylpiperazin-1-yl)carbonyl-pyridine-3-carboxamide Openeye Name: N-tert-butyl-1-cyclohexyl-4-oxo-5-(4-phenylpiperazine-1-carbonyl)pyridine-3-carboxamide CAS Name: N-tert-butyl-1-cyclohexyl-4-oxo-5-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-tert-butyl-1-cyclohexyl-4-oxo-5-(4-phenylpiperazine-1-carbonyl)pyridine-3-carboxamide Traditional Name: N-tert-butyl-1-cyclohexyl-4-keto-5-(4-phenylpiperazine-1-carbonyl)nicotinamide Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC(C)(C)NC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C27H36N4O3/c1-27(2,3)28-25(33)22-18-31(21-12-8-5-9-13-21)19-23(24(22)32)26(34)30-16-14-29(15-17-30)20-10-6-4-7-11-20/h4,6-7,10-11,18-19,21H,5,8-9,12-17H2,1-3H3,(H,28,33)