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

Systemtic Name: N-[(3R,4S)-4-[4-(3-ethanoylphenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Openeye Name: N-[(3R,4S)-4-[4-(3-acetylphenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide CAS Name: N-[(3R,4S)-4-[4-(3-acetylphenyl)phenyl]-1-methyl-3-pyrrolidinyl]-2-propanesulfonamide IUPAC Name: N-[(3R,4S)-4-[4-(3-acetylphenyl)phenyl]-1-methylpyrrolidin-3-yl]propane-2-sulfonamide Traditional Name: N-[(3R,4S)-4-[4-(3-acetylphenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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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)C(=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)C(=O)C)C

InChI

InChI=1S/C22H28N2O3S/c1-15(2)28(26,27)23-22-14-24(4)13-21(22)18-10-8-17(9-11-18)20-7-5-6-19(12-20)16(3)25/h5-12,15,21-23H,13-14H2,1-4H3/t21-,22+/m1/s1