6-(4-pentanoylpiperazin-1-yl)-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide

Systemtic Name: 6-(4-pentanoylpiperazin-1-yl)-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-6-(4-pentanoylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: 6-[4-(1-oxopentyl)-1-piperazinyl]-N-(4-phenylbutan-2-yl)-3-pyridinecarboxamide IUPAC Name: 6-(4-pentanoylpiperazin-1-yl)-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide Traditional Name: N-(1-methyl-3-phenyl-propyl)-6-(4-valerylpiperazino)nicotinamide Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NC(C)CCC3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NC(C)CCC3=CC=CC=C3

InChI

InChI=1S/C25H34N4O2/c1-3-4-10-24(30)29-17-15-28(16-18-29)23-14-13-22(19-26-23)25(31)27-20(2)11-12-21-8-6-5-7-9-21/h5-9,13-14,19-20H,3-4,10-12,15-18H2,1-2H3,(H,27,31)