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

Systemtic Name: N-[(3R,4S)-1-methyl-4-[4-(3-methylsulfonylphenyl)phenyl]pyrrolidin-3-yl]propane-2-sulfonamide Openeye Name: N-[(3R,4S)-1-methyl-4-[4-(3-methylsulfonylphenyl)phenyl]pyrrolidin-3-yl]propane-2-sulfonamide CAS Name: N-[(3R,4S)-1-methyl-4-[4-(3-methylsulfonylphenyl)phenyl]-3-pyrrolidinyl]-2-propanesulfonamide IUPAC Name: N-[(3R,4S)-1-methyl-4-[4-(3-methylsulfonylphenyl)phenyl]pyrrolidin-3-yl]propane-2-sulfonamide Traditional Name: N-[(3R,4S)-4-[4-(3-mesylphenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O4S2/c1-15(2)29(26,27)22-21-14-23(3)13-20(21)17-10-8-16(9-11-17)18-6-5-7-19(12-18)28(4,24)25/h5-12,15,20-22H,13-14H2,1-4H3/t20-,21+/m1/s1