N-(3,3-dimethyl-1-phenyl-butyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(3,3-dimethyl-1-phenyl-butyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-(3,3-dimethyl-1-phenyl-butyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-(3,3-dimethyl-1-phenylbutyl)-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(3,3-dimethyl-1-phenylbutyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-(3,3-dimethyl-1-phenyl-butyl)-1-(2-pyrimidyl)isonipecotamide Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C22H30N4O/c1-22(2,3)16-19(17-8-5-4-6-9-17)25-20(27)18-10-14-26(15-11-18)21-23-12-7-13-24-21/h4-9,12-13,18-19H,10-11,14-16H2,1-3H3,(H,25,27)