N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]isonipecotamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)C

InChI

InChI=1S/C22H30N4O4S/c1-16-14-17(2)26(24-16)11-5-10-23-22(28)19-8-12-25(13-9-19)31(29,30)21-7-4-6-20(15-21)18(3)27/h4,6-7,14-15,19H,5,8-13H2,1-3H3,(H,23,28)