N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-3-yl]-1-mesyl-isonipecotamide Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=NN(C=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=NN(C=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C17H21ClN4O3S/c1-26(24,25)22-10-6-13(7-11-22)17(23)19-16-8-9-21(20-16)12-14-4-2-3-5-15(14)18/h2-5,8-9,13H,6-7,10-12H2,1H3,(H,19,20,23)