1-(3,4-dimethylphenyl)sulfonyl-N-[[3-(methylsulfonylamino)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[[3-(methylsulfonylamino)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[[3-(methanesulfonamido)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[[3-(methanesulfonamido)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[[3-(methanesulfonamido)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[3-(methanesulfonamido)benzyl]isonipecotamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C)C

InChI

InChI=1S/C22H29N3O5S2/c1-16-7-8-21(13-17(16)2)32(29,30)25-11-9-19(10-12-25)22(26)23-15-18-5-4-6-20(14-18)24-31(3,27)28/h4-8,13-14,19,24H,9-12,15H2,1-3H3,(H,23,26)