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

Systemtic Name: 6-chloranyl-3-methyl-N-[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide Openeye Name: 6-chloro-3-methyl-N-[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]benzothiophene-2-sulfonamide CAS Name: 6-chloro-3-methyl-N-[1-[[4-(2-methylsulfonylphenyl)phenyl]-oxomethyl]-3-pyrrolidinyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 6-chloro-3-methyl-N-[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide Traditional Name: 6-chloro-N-[1-[4-(2-mesylphenyl)benzoyl]pyrrolidin-3-yl]-3-methyl-benzothiophene-2-sulfonamide Formula: C27H25ClN2O5S3 MolecularWeight: 589.1458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=CC(=C2)Cl)S(=O)(=O)NC3CCN(C3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)C

Isomeric SMILES

CC1=C(SC2=C1C=CC(=C2)Cl)S(=O)(=O)NC3CCN(C3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)C

InChI

InChI=1S/C27H25ClN2O5S3/c1-17-22-12-11-20(28)15-24(22)36-27(17)38(34,35)29-21-13-14-30(16-21)26(31)19-9-7-18(8-10-19)23-5-3-4-6-25(23)37(2,32)33/h3-12,15,21,29H,13-14,16H2,1-2H3