N-[(1-phenylpyrazol-4-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1-phenylpyrazol-4-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1-phenylpyrazol-4-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(1-phenyl-4-pyrazolyl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(1-phenylpyrazol-4-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-mesitylsulfonyl-N-[(1-phenylpyrazol-4-yl)methyl]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)NCC3=CN(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4)C

InChI

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