N-[(4-methylphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(p-tolylmethyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-isonipecotamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)C)C

InChI

InChI=1S/C20H28N4O3S/c1-14-5-7-17(8-6-14)13-21-20(25)18-9-11-24(12-10-18)28(26,27)19-15(2)22-23(4)16(19)3/h5-8,18H,9-13H2,1-4H3,(H,21,25)