N-[(4-chlorophenyl)methyl]-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(1-tosylisonipecotoyl)pyrrolidine-2-carboxamide Formula: C25H30ClN3O4S MolecularWeight: 504.0414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H30ClN3O4S/c1-18-4-10-22(11-5-18)34(32,33)28-15-12-20(13-16-28)25(31)29-14-2-3-23(29)24(30)27-17-19-6-8-21(26)9-7-19/h4-11,20,23H,2-3,12-17H2,1H3,(H,27,30)