(3S)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-ethanoyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-ethanoyl-piperidine-3-carboxamide Openeye Name: (3S)-1-acetyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperidine-3-carboxamide CAS Name: (3S)-1-acetyl-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-acetyl-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-acetyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]nipecotamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3CCCN(C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)[C@H]3CCCN(C3)C(=O)C

InChI

InChI=1S/C20H26N4O2/c1-14-19(15(2)24(22-14)18-9-5-4-6-10-18)12-21-20(26)17-8-7-11-23(13-17)16(3)25/h4-6,9-10,17H,7-8,11-13H2,1-3H3,(H,21,26)/t17-/m0/s1