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

Systemtic Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methyl]-3-pyrazolyl]-1-(4-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-1-(4-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-chlorobenzyl)pyrazol-3-yl]-1-(4-cyanophenyl)sulfonyl-isonipecotamide Formula: C23H22ClN5O3S MolecularWeight: 483.97048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22ClN5O3S/c24-20-5-1-18(2-6-20)16-29-22(9-12-26-29)27-23(30)19-10-13-28(14-11-19)33(31,32)21-7-3-17(15-25)4-8-21/h1-9,12,19H,10-11,13-14,16H2,(H,27,30)