N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-[2-(phenylcarbamoylamino)ethanoyl]piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-[2-(phenylcarbamoylamino)ethanoyl]piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-[2-(phenylcarbamoylamino)acetyl]-4-piperidyl]pyridine-3-carboxamide CAS Name: 2-[1-[2-[[anilino(oxo)methyl]amino]-1-oxoethyl]-4-piperidinyl]-N-[3-(1-imidazolyl)propyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-[2-(phenylcarbamoylamino)acetyl]piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-6-methyl-2-[1-[2-(phenylcarbamoylamino)acetyl]-4-piperidyl]nicotinamide Formula: C27H33N7O3 MolecularWeight: 503.59602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)CNC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)CNC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H33N7O3/c1-20-8-9-23(26(36)29-12-5-14-33-17-13-28-19-33)25(31-20)21-10-15-34(16-11-21)24(35)18-30-27(37)32-22-6-3-2-4-7-22/h2-4,6-9,13,17,19,21H,5,10-12,14-16,18H2,1H3,(H,29,36)(H2,30,32,37)