5-chloranyl-3-methyl-N-[[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-3-methyl-N-[[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-3-methyl-N-[[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]methyl]benzothiophene-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-[[1-[[4-(2-methylsulfonylphenyl)phenyl]-oxomethyl]-3-pyrrolidinyl]methyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-3-methyl-N-[[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]methyl]-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-N-[[1-[4-(2-mesylphenyl)benzoyl]pyrrolidin-3-yl]methyl]-3-methyl-benzothiophene-2-sulfonamide Formula: C28H27ClN2O5S3 MolecularWeight: 603.17238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NCC3CCN(C3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NCC3CCN(C3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)C

InChI

InChI=1S/C28H27ClN2O5S3/c1-18-24-15-22(29)11-12-25(24)37-28(18)39(35,36)30-16-19-13-14-31(17-19)27(32)21-9-7-20(8-10-21)23-5-3-4-6-26(23)38(2,33)34/h3-12,15,19,30H,13-14,16-17H2,1-2H3