5-(4-cyclohexylpiperazin-1-yl)carbonyl-N-ethyl-4-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: 5-(4-cyclohexylpiperazin-1-yl)carbonyl-N-ethyl-4-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 1-benzyl-5-(4-cyclohexylpiperazine-1-carbonyl)-N-ethyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-N-ethyl-4-oxo-1-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 1-benzyl-5-(4-cyclohexylpiperazine-1-carbonyl)-N-ethyl-4-oxopyridine-3-carboxamide Traditional Name: 1-benzyl-5-(4-cyclohexylpiperazine-1-carbonyl)-N-ethyl-4-keto-nicotinamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H34N4O3/c1-2-27-25(32)22-18-28(17-20-9-5-3-6-10-20)19-23(24(22)31)26(33)30-15-13-29(14-16-30)21-11-7-4-8-12-21/h3,5-6,9-10,18-19,21H,2,4,7-8,11-17H2,1H3,(H,27,32)