N-(3-imidazol-1-ylpropyl)-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-6-[4-(3-methyl-1-oxopentyl)-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-6-[4-(3-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-6-[4-(3-methylpentanoyl)piperazino]nicotinamide Formula: C22H32N6O2 MolecularWeight: 412.52848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CCC(C)CC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C22H32N6O2/c1-3-18(2)15-21(29)28-13-11-27(12-14-28)20-6-5-19(16-25-20)22(30)24-7-4-9-26-10-8-23-17-26/h5-6,8,10,16-18H,3-4,7,9,11-15H2,1-2H3,(H,24,30)