2-(1-benzothiophen-3-ylsulfanyl)-3-(4-hydroxyphenyl)-5-(2-oxidanyl-3-piperidin-3-yl-propoxy)phenol

Systemtic Name: 2-(1-benzothiophen-3-ylsulfanyl)-3-(4-hydroxyphenyl)-5-(2-oxidanyl-3-piperidin-3-yl-propoxy)phenol Openeye Name: 2-(benzothiophen-3-ylsulfanyl)-3-(4-hydroxyphenyl)-5-[2-hydroxy-3-(3-piperidyl)propoxy]phenol CAS Name: 2-(1-benzothiophen-3-ylthio)-3-(4-hydroxyphenyl)-5-[2-hydroxy-3-(3-piperidinyl)propoxy]phenol IUPAC Name: 2-(1-benzothiophen-3-ylsulfanyl)-3-(4-hydroxyphenyl)-5-(2-hydroxy-3-piperidin-3-ylpropoxy)phenol Traditional Name: 2-(benzothiophen-3-ylthio)-3-(4-hydroxyphenyl)-5-[2-hydroxy-3-(3-piperidyl)propoxy]phenol Formula: C28H29NO4S2 MolecularWeight: 507.66416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)CC(COC2=CC(=C(C(=C2)C3=CC=C(C=C3)O)SC4=CSC5=CC=CC=C54)O)O

Isomeric SMILES

C1CC(CNC1)CC(COC2=CC(=C(C(=C2)C3=CC=C(C=C3)O)SC4=CSC5=CC=CC=C54)O)O

InChI

InChI=1S/C28H29NO4S2/c30-20-9-7-19(8-10-20)24-13-22(33-16-21(31)12-18-4-3-11-29-15-18)14-25(32)28(24)35-27-17-34-26-6-2-1-5-23(26)27/h1-2,5-10,13-14,17-18,21,29-32H,3-4,11-12,15-16H2