N-[2-(pyrazol-1-ylmethyl)phenyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(pyrazol-1-ylmethyl)phenyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(pyrazol-1-ylmethyl)phenyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(1-pyrazolylmethyl)phenyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(pyrazol-1-ylmethyl)phenyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-mesitylsulfonyl-N-[2-(pyrazol-1-ylmethyl)phenyl]isonipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3CN4C=CC=N4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3CN4C=CC=N4)C

InChI

InChI=1S/C25H30N4O3S/c1-18-15-19(2)24(20(3)16-18)33(31,32)29-13-9-21(10-14-29)25(30)27-23-8-5-4-7-22(23)17-28-12-6-11-26-28/h4-8,11-12,15-16,21H,9-10,13-14,17H2,1-3H3,(H,27,30)