3-methyl-2-(4-methylsulfanylphenyl)-1-(8-pyrrolidin-1-yloctyl)indol-5-ol

Systemtic Name: 3-methyl-2-(4-methylsulfanylphenyl)-1-(8-pyrrolidin-1-yloctyl)indol-5-ol Openeye Name: 3-methyl-2-(4-methylsulfanylphenyl)-1-(8-pyrrolidin-1-yloctyl)indol-5-ol CAS Name: 3-methyl-2-[4-(methylthio)phenyl]-1-[8-(1-pyrrolidinyl)octyl]-5-indolol IUPAC Name: 3-methyl-2-(4-methylsulfanylphenyl)-1-(8-pyrrolidin-1-yloctyl)indol-5-ol Traditional Name: 3-methyl-2-[4-(methylthio)phenyl]-1-(8-pyrrolidinooctyl)indol-5-ol Formula: C28H38N2OS MolecularWeight: 450.67912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCCCN3CCCC3)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCCCN3CCCC3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C28H38N2OS/c1-22-26-21-24(31)13-16-27(26)30(28(22)23-11-14-25(32-2)15-12-23)20-8-6-4-3-5-7-17-29-18-9-10-19-29/h11-16,21,31H,3-10,17-20H2,1-2H3