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

Systemtic Name: N-[(1R)-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenyl-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R)-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenyl-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R)-2-[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-1-phenylethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R)-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenylethyl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N-[(1R)-2-[(2S)-2-methylolpyrrolidino]-1-phenyl-ethyl]benzenesulfonamide Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CN2CCCC2CO)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CN2CCC[C@H]2CO)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2O3S/c1-16-9-11-19(12-10-16)26(24,25)21-20(17-6-3-2-4-7-17)14-22-13-5-8-18(22)15-23/h2-4,6-7,9-12,18,20-21,23H,5,8,13-15H2,1H3/t18-,20-/m0/s1