N-[[3-(methylsulfonylamino)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[3-(methylsulfonylamino)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-[[3-(methanesulfonamido)phenyl]methyl]piperidine-4-carboxamide CAS Name: N-[[3-(methanesulfonamido)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[3-(methanesulfonamido)phenyl]methyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(methanesulfonamido)benzyl]-1-p-cumenylsulfonyl-isonipecotamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S2/c1-17(2)19-7-9-22(10-8-19)33(30,31)26-13-11-20(12-14-26)23(27)24-16-18-5-4-6-21(15-18)25-32(3,28)29/h4-10,15,17,20,25H,11-14,16H2,1-3H3,(H,24,27)