3-methyl-2-(4-methylsulfanylphenyl)-1-[6-(1-phenylethylamino)hexyl]indol-5-ol

Systemtic Name: 3-methyl-2-(4-methylsulfanylphenyl)-1-[6-(1-phenylethylamino)hexyl]indol-5-ol Openeye Name: 3-methyl-2-(4-methylsulfanylphenyl)-1-[6-(1-phenylethylamino)hexyl]indol-5-ol CAS Name: 3-methyl-2-[4-(methylthio)phenyl]-1-[6-(1-phenylethylamino)hexyl]-5-indolol IUPAC Name: 3-methyl-2-(4-methylsulfanylphenyl)-1-[6-(1-phenylethylamino)hexyl]indol-5-ol Traditional Name: 3-methyl-2-[4-(methylthio)phenyl]-1-[6-(1-phenylethylamino)hexyl]indol-5-ol Formula: C30H36N2OS MolecularWeight: 472.68464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCNC(C)C3=CC=CC=C3)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCNC(C)C3=CC=CC=C3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C30H36N2OS/c1-22-28-21-26(33)15-18-29(28)32(30(22)25-13-16-27(34-3)17-14-25)20-10-5-4-9-19-31-23(2)24-11-7-6-8-12-24/h6-8,11-18,21,23,31,33H,4-5,9-10,19-20H2,1-3H3