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

Systemtic Name: N-[(3R,4S)-4-[4-(4-cyanophenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Openeye Name: N-[(3R,4S)-4-[4-(4-cyanophenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide CAS Name: N-[(3R,4S)-4-[4-(4-cyanophenyl)phenyl]-1-methyl-3-pyrrolidinyl]-2-propanesulfonamide IUPAC Name: N-[(3R,4S)-4-[4-(4-cyanophenyl)phenyl]-1-methylpyrrolidin-3-yl]propane-2-sulfonamide Traditional Name: N-[(3R,4S)-4-[4-(4-cyanophenyl)phenyl]-1-methyl-pyrrolidin-3-yl]propane-2-sulfonamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2S/c1-15(2)27(25,26)23-21-14-24(3)13-20(21)19-10-8-18(9-11-19)17-6-4-16(12-22)5-7-17/h4-11,15,20-21,23H,13-14H2,1-3H3/t20-,21+/m1/s1