N-(2-ethyl-6-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-1-(4-methyl-2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)isonipecotamide Formula: C20H26N4O MolecularWeight: 338.44664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)C3=NC=CC(=N3)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)C3=NC=CC(=N3)C)C

InChI

InChI=1S/C20H26N4O/c1-4-16-7-5-6-14(2)18(16)23-19(25)17-9-12-24(13-10-17)20-21-11-8-15(3)22-20/h5-8,11,17H,4,9-10,12-13H2,1-3H3,(H,23,25)