2-(4-hydroxyphenyl)-3-methyl-1-(8-pyridin-2-ylsulfanyloctyl)indol-5-ol

Systemtic Name: 2-(4-hydroxyphenyl)-3-methyl-1-(8-pyridin-2-ylsulfanyloctyl)indol-5-ol Openeye Name: 2-(4-hydroxyphenyl)-3-methyl-1-[8-(2-pyridylsulfanyl)octyl]indol-5-ol CAS Name: 2-(4-hydroxyphenyl)-3-methyl-1-[8-(2-pyridinylthio)octyl]-5-indolol IUPAC Name: 2-(4-hydroxyphenyl)-3-methyl-1-(8-pyridin-2-ylsulfanyloctyl)indol-5-ol Traditional Name: 2-(4-hydroxyphenyl)-3-methyl-1-[8-(2-pyridylthio)octyl]indol-5-ol Formula: C28H32N2O2S MolecularWeight: 460.63088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCCCSC3=CC=CC=N3)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCCCSC3=CC=CC=N3)C4=CC=C(C=C4)O

InChI

InChI=1S/C28H32N2O2S/c1-21-25-20-24(32)15-16-26(25)30(28(21)22-11-13-23(31)14-12-22)18-8-4-2-3-5-9-19-33-27-10-6-7-17-29-27/h6-7,10-17,20,31-32H,2-5,8-9,18-19H2,1H3