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

Systemtic Name: 6-(4-pentanoylpiperazin-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide Openeye Name: 6-(4-pentanoylpiperazin-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide CAS Name: 6-[4-(1-oxopentyl)-1-piperazinyl]-N-(4-phenylbutyl)-3-pyridinecarboxamide IUPAC Name: 6-(4-pentanoylpiperazin-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide Traditional Name: N-(4-phenylbutyl)-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)NCCCCC3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C25H34N4O2/c1-2-3-12-24(30)29-18-16-28(17-19-29)23-14-13-22(20-27-23)25(31)26-15-8-7-11-21-9-5-4-6-10-21/h4-6,9-10,13-14,20H,2-3,7-8,11-12,15-19H2,1H3,(H,26,31)