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

Systemtic Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[(3-chlorophenyl)methyl]-3-pyrazolyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(3-chlorophenyl)methyl]pyrazol-3-yl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-chlorobenzyl)pyrazol-3-yl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H22ClFN4O3S MolecularWeight: 476.951483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22ClFN4O3S/c23-18-3-1-2-16(14-18)15-28-21(8-11-25-28)26-22(29)17-9-12-27(13-10-17)32(30,31)20-6-4-19(24)5-7-20/h1-8,11,14,17H,9-10,12-13,15H2,(H,26,29)