1-(4-methylphenyl)sulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(p-tolylsulfonyl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(4-pyrrolidinosulfonylbenzyl)-1-tosyl-isonipecotamide Formula: C24H31N3O5S2 MolecularWeight: 505.65004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H31N3O5S2/c1-19-4-8-22(9-5-19)34(31,32)27-16-12-21(13-17-27)24(28)25-18-20-6-10-23(11-7-20)33(29,30)26-14-2-3-15-26/h4-11,21H,2-3,12-18H2,1H3,(H,25,28)