N-(3-methyl-1-phenyl-butyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(3-methyl-1-phenyl-butyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide Openeye Name: N-(3-methyl-1-phenyl-butyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide CAS Name: N-(3-methyl-1-phenylbutyl)-1-(2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-(3-methyl-1-phenylbutyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide Traditional Name: N-(3-methyl-1-phenyl-butyl)-1-(2-pyrimidyl)nipecotamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O/c1-16(2)14-19(17-8-4-3-5-9-17)24-20(26)18-10-6-13-25(15-18)21-22-11-7-12-23-21/h3-5,7-9,11-12,16,18-19H,6,10,13-15H2,1-2H3,(H,24,26)