4-[[(2S,5R)-5-[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-2-yl]methylsulfanyl]phenol

Systemtic Name: 4-[[(2S,5R)-5-[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-2-yl]methylsulfanyl]phenol Openeye Name: 4-[[(2S,5R)-5-[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-2-yl]methylsulfanyl]phenol CAS Name: 4-[[(2S,5R)-5-[[(4-hydroxyphenyl)thio]methyl]-2-pyrrolidinyl]methylthio]phenol IUPAC Name: 4-[[(2S,5R)-5-[(4-hydroxyphenyl)sulfanylmethyl]pyrrolidin-2-yl]methylsulfanyl]phenol Traditional Name: 4-[[(2S,5R)-5-[[(4-hydroxyphenyl)thio]methyl]pyrrolidin-2-yl]methylthio]phenol Formula: C18H21NO2S2 MolecularWeight: 347.49484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1CSC2=CC=C(C=C2)O)CSC3=CC=C(C=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO2S2/c20-15-3-7-17(8-4-15)22-11-13-1-2-14(19-13)12-23-18-9-5-16(21)6-10-18/h3-10,13-14,19-21H,1-2,11-12H2/t13-,14+