1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(4-methylphenyl)sulfanylethyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(4-methylphenyl)sulfanylethyl]pyrrolidine-2-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(p-tolylsulfanyl)ethyl]pyrrolidine-2-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-[(4-methylphenyl)thio]ethyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(4-methylphenyl)sulfanylethyl]pyrrolidine-2-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(p-tolylthio)ethyl]pyrrolidine-2-carboxamide Formula: C22H26N2O5S2 MolecularWeight: 462.58224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H26N2O5S2/c1-16-4-6-17(7-5-16)30-14-10-23-22(25)19-3-2-11-24(19)31(26,27)18-8-9-20-21(15-18)29-13-12-28-20/h4-9,15,19H,2-3,10-14H2,1H3,(H,23,25)