N-[(2R)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-phenyl-propan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2R)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-phenyl-propan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R)-1-benzyl-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2R)-1-[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-3-phenylpropan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2R)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-phenylpropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R)-1-benzyl-2-[(2S)-2-methylolpyrrolidino]ethyl]-4-methyl-benzenesulfonamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)CN3CCCC3CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC2=CC=CC=C2)CN3CCC[C@H]3CO

InChI

InChI=1S/C21H28N2O3S/c1-17-9-11-21(12-10-17)27(25,26)22-19(14-18-6-3-2-4-7-18)15-23-13-5-8-20(23)16-24/h2-4,6-7,9-12,19-20,22,24H,5,8,13-16H2,1H3/t19-,20+/m1/s1