(3S)-N-(4-chlorophenyl)-1-(1-methylpyrazol-4-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-chlorophenyl)-1-(1-methylpyrazol-4-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(4-chlorophenyl)-1-(1-methylpyrazol-4-yl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(4-chlorophenyl)-1-[(1-methyl-4-pyrazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-chlorophenyl)-1-(1-methylpyrazol-4-yl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(4-chlorophenyl)-1-(1-methylpyrazol-4-yl)sulfonyl-nipecotamide Formula: C16H19ClN4O3S MolecularWeight: 382.86506

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=C(C=N1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H19ClN4O3S/c1-20-11-15(9-18-20)25(23,24)21-8-2-3-12(10-21)16(22)19-14-6-4-13(17)5-7-14/h4-7,9,11-12H,2-3,8,10H2,1H3,(H,19,22)/t12-/m0/s1