3-[ethylsulfanyl-[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol

Systemtic Name: 3-[ethylsulfanyl-[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Openeye Name: 3-[ethylsulfanyl-[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol CAS Name: 3-[(ethylthio)-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol IUPAC Name: 3-[ethylsulfanyl-[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Traditional Name: 3-[(ethylthio)-[4-(2-piperidinoethoxy)phenyl]methyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol Formula: C30H33NO3S2 MolecularWeight: 519.71792

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1=CC=C(C=C1)OCCN2CCCCC2)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

CCSC(C1=CC=C(C=C1)OCCN2CCCCC2)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C30H33NO3S2/c1-2-35-29(21-8-13-25(14-9-21)34-19-18-31-16-4-3-5-17-31)28-26-15-12-24(33)20-27(26)36-30(28)22-6-10-23(32)11-7-22/h6-15,20,29,32-33H,2-5,16-19H2,1H3