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

Systemtic Name: (3R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-mesyl-nipecotamide Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O3S/c1-14-18(15(2)23(21-14)17-9-5-4-6-10-17)12-20-19(24)16-8-7-11-22(13-16)27(3,25)26/h4-6,9-10,16H,7-8,11-13H2,1-3H3,(H,20,24)/t16-/m1/s1