2-(4-hydroxyphenyl)-3-methyl-1-[10-(1-methylimidazol-2-yl)sulfanyldecyl]indol-5-ol

Systemtic Name: 2-(4-hydroxyphenyl)-3-methyl-1-[10-(1-methylimidazol-2-yl)sulfanyldecyl]indol-5-ol Openeye Name: 2-(4-hydroxyphenyl)-3-methyl-1-[10-(1-methylimidazol-2-yl)sulfanyldecyl]indol-5-ol CAS Name: 2-(4-hydroxyphenyl)-3-methyl-1-[10-[(1-methyl-2-imidazolyl)thio]decyl]-5-indolol IUPAC Name: 2-(4-hydroxyphenyl)-3-methyl-1-[10-(1-methylimidazol-2-yl)sulfanyldecyl]indol-5-ol Traditional Name: 2-(4-hydroxyphenyl)-3-methyl-1-[10-[(1-methylimidazol-2-yl)thio]decyl]indol-5-ol Formula: C29H37N3O2S MolecularWeight: 491.68798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCCCCCSC3=NC=CN3C)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CCCCCCCCCCSC3=NC=CN3C)C4=CC=C(C=C4)O

InChI

InChI=1S/C29H37N3O2S/c1-22-26-21-25(34)15-16-27(26)32(28(22)23-11-13-24(33)14-12-23)18-9-7-5-3-4-6-8-10-20-35-29-30-17-19-31(29)2/h11-17,19,21,33-34H,3-10,18,20H2,1-2H3