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

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-ethyl-6-methyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-ethyl-6-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-N-(2-ethyl-6-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-ethyl-6-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-ethyl-6-methyl-phenyl)isonipecotamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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