N-[2-(phenylmethyl)pyrazol-3-yl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(phenylmethyl)pyrazol-3-yl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(phenylmethyl)-3-pyrazolyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-1-mesitylsulfonyl-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=NN3CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=NN3CC4=CC=CC=C4)C

InChI

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