(3S,4S)-4-[2-hydroxyethyl(thiophen-2-ylmethyl)amino]-1-(phenylsulfonyl)pyrrolidin-3-ol

Systemtic Name: (3S,4S)-4-[2-hydroxyethyl(thiophen-2-ylmethyl)amino]-1-(phenylsulfonyl)pyrrolidin-3-ol Openeye Name: (3S,4S)-1-(benzenesulfonyl)-4-[2-hydroxyethyl(2-thienylmethyl)amino]pyrrolidin-3-ol CAS Name: (3S,4S)-1-(benzenesulfonyl)-4-[2-hydroxyethyl(thiophen-2-ylmethyl)amino]-3-pyrrolidinol IUPAC Name: (3S,4S)-1-(benzenesulfonyl)-4-[2-hydroxyethyl(thiophen-2-ylmethyl)amino]pyrrolidin-3-ol Traditional Name: (3S,4S)-1-besyl-4-[2-hydroxyethyl(2-thenyl)amino]pyrrolidin-3-ol Formula: C17H22N2O4S2 MolecularWeight: 382.49758

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1S(=O)(=O)C2=CC=CC=C2)O)N(CCO)CC3=CC=CS3

Isomeric SMILES

C1[C@@H]([C@H](CN1S(=O)(=O)C2=CC=CC=C2)O)N(CCO)CC3=CC=CS3

InChI

InChI=1S/C17H22N2O4S2/c20-9-8-18(11-14-5-4-10-24-14)16-12-19(13-17(16)21)25(22,23)15-6-2-1-3-7-15/h1-7,10,16-17,20-21H,8-9,11-13H2/t16-,17-/m0/s1