N-butyl-4-[6-[2-(4-hydroxyphenyl)-3-methyl-5-oxidanyl-indol-1-yl]hexylsulfanyl]-N-methyl-butanamide

Systemtic Name: N-butyl-4-[6-[2-(4-hydroxyphenyl)-3-methyl-5-oxidanyl-indol-1-yl]hexylsulfanyl]-N-methyl-butanamide Openeye Name: N-butyl-4-[6-[5-hydroxy-2-(4-hydroxyphenyl)-3-methyl-indol-1-yl]hexylsulfanyl]-N-methyl-butanamide CAS Name: N-butyl-4-[6-[5-hydroxy-2-(4-hydroxyphenyl)-3-methyl-1-indolyl]hexylthio]-N-methylbutanamide IUPAC Name: N-butyl-4-[6-[5-hydroxy-2-(4-hydroxyphenyl)-3-methylindol-1-yl]hexylsulfanyl]-N-methylbutanamide Traditional Name: N-butyl-4-[6-[5-hydroxy-2-(4-hydroxyphenyl)-3-methyl-indol-1-yl]hexylthio]-N-methyl-butyramide Formula: C30H42N2O3S MolecularWeight: 510.73108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CCCSCCCCCCN1C2=C(C=C(C=C2)O)C(=C1C3=CC=C(C=C3)O)C

Isomeric SMILES

CCCCN(C)C(=O)CCCSCCCCCCN1C2=C(C=C(C=C2)O)C(=C1C3=CC=C(C=C3)O)C

InChI

InChI=1S/C30H42N2O3S/c1-4-5-18-31(3)29(35)11-10-21-36-20-9-7-6-8-19-32-28-17-16-26(34)22-27(28)23(2)30(32)24-12-14-25(33)15-13-24/h12-17,22,33-34H,4-11,18-21H2,1-3H3