2-[(2S,5R)-2,5-bis[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-1-yl]ethanamide

Systemtic Name: 2-[(2S,5R)-2,5-bis[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-1-yl]ethanamide Openeye Name: 2-[(2S,5R)-2,5-bis[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-1-yl]acetamide CAS Name: 2-[(2S,5R)-2,5-bis[[(4-hydroxyphenyl)thio]methyl]-1-pyrrolidinyl]acetamide IUPAC Name: 2-[(2S,5R)-2,5-bis[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-1-yl]acetamide Traditional Name: 2-[(2S,5R)-2,5-bis[[(4-hydroxyphenyl)thio]methyl]pyrrolidino]acetamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1CSC2=CC=C(C=C2)O)CC(=O)N)CSC3=CC=C(C=C3)O

Isomeric SMILES

C1C[C@H](N([C@H]1CSC2=CC=C(C=C2)O)CC(=O)N)CSC3=CC=C(C=C3)O

InChI

InChI=1S/C20H24N2O3S2/c21-20(25)11-22-14(12-26-18-7-3-16(23)4-8-18)1-2-15(22)13-27-19-9-5-17(24)6-10-19/h3-10,14-15,23-24H,1-2,11-13H2,(H2,21,25)/t14-,15+