6-imidazol-1-yl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 6-imidazol-1-yl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 6-imidazol-1-yl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide CAS Name: 6-(1-imidazolyl)-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 6-imidazol-1-yl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 6-imidazol-1-yl-N-[3-(isobutyrylamino)benzyl]nicotinamide Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CN=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CN=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C20H21N5O2/c1-14(2)19(26)24-17-5-3-4-15(10-17)11-23-20(27)16-6-7-18(22-12-16)25-9-8-21-13-25/h3-10,12-14H,11H2,1-2H3,(H,23,27)(H,24,26)