6-[4-(4-methylhexanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide

Systemtic Name: 6-[4-(4-methylhexanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide Openeye Name: 6-[4-(4-methylhexanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide CAS Name: 6-[4-(4-methyl-1-oxohexyl)-1-piperazinyl]-N-(3-phenylpropyl)-3-pyridinecarboxamide IUPAC Name: 6-[4-(4-methylhexanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide Traditional Name: 6-[4-(4-methylhexanoyl)piperazino]-N-(3-phenylpropyl)nicotinamide Formula: C26H36N4O2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CCC(C)CCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C26H36N4O2/c1-3-21(2)11-14-25(31)30-18-16-29(17-19-30)24-13-12-23(20-28-24)26(32)27-15-7-10-22-8-5-4-6-9-22/h4-6,8-9,12-13,20-21H,3,7,10-11,14-19H2,1-2H3,(H,27,32)