N-[2-(1H-imidazol-5-yl)ethyl]-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-(1H-imidazol-5-yl)ethyl]-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide Openeye Name: N-[2-(1H-imidazol-5-yl)ethyl]-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide CAS Name: N-[2-(1H-imidazol-5-yl)ethyl]-6-[4-(3-methyl-1-oxopentyl)-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(1H-imidazol-5-yl)ethyl]-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-[2-(1H-imidazol-5-yl)ethyl]-6-[4-(3-methylpentanoyl)piperazino]nicotinamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCC3=CN=CN3

Isomeric SMILES

CCC(C)CC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCC3=CN=CN3

InChI

InChI=1S/C21H30N6O2/c1-3-16(2)12-20(28)27-10-8-26(9-11-27)19-5-4-17(13-24-19)21(29)23-7-6-18-14-22-15-25-18/h4-5,13-16H,3,6-12H2,1-2H3,(H,22,25)(H,23,29)