N-[(3R,4S)-4-[4-(1-benzothiophen-3-yl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide

Systemtic Name: N-[(3R,4S)-4-[4-(1-benzothiophen-3-yl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Openeye Name: N-[(3R,4S)-4-[4-(benzothiophen-3-yl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide CAS Name: N-[(3R,4S)-4-[4-(1-benzothiophen-3-yl)phenyl]-1-methyl-3-pyrrolidinyl]-2-propanesulfonamide IUPAC Name: N-[(3R,4S)-4-[4-(1-benzothiophen-3-yl)phenyl]-1-methylpyrrolidin-3-yl]propane-2-sulfonamide Traditional Name: N-[(3R,4S)-4-[4-(benzothiophen-3-yl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NC1CN(CC1C2=CC=C(C=C2)C3=CSC4=CC=CC=C43)C

Isomeric SMILES

CC(C)S(=O)(=O)N[C@H]1CN(C[C@@H]1C2=CC=C(C=C2)C3=CSC4=CC=CC=C43)C

InChI

InChI=1S/C22H26N2O2S2/c1-15(2)28(25,26)23-21-13-24(3)12-19(21)16-8-10-17(11-9-16)20-14-27-22-7-5-4-6-18(20)22/h4-11,14-15,19,21,23H,12-13H2,1-3H3/t19-,21+/m1/s1