N-(2,6-diethylphenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide Openeye Name: N-(2,6-diethylphenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-1-(4-methyl-2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-(2,6-diethylphenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide Traditional Name: N-(2,6-diethylphenyl)-1-(4-methylpyrimidin-2-yl)nipecotamide Formula: C21H28N4O MolecularWeight: 352.47322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2CCCN(C2)C3=NC=CC(=N3)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2CCCN(C2)C3=NC=CC(=N3)C

InChI

InChI=1S/C21H28N4O/c1-4-16-8-6-9-17(5-2)19(16)24-20(26)18-10-7-13-25(14-18)21-22-12-11-15(3)23-21/h6,8-9,11-12,18H,4-5,7,10,13-14H2,1-3H3,(H,24,26)