N-(2,6-dimethylphenyl)-2-[2-(4-hydroxyphenyl)sulfanylcyclohexyl]sulfanyl-ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[2-(4-hydroxyphenyl)sulfanylcyclohexyl]sulfanyl-ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[2-(4-hydroxyphenyl)sulfanylcyclohexyl]sulfanyl-acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[2-[(4-hydroxyphenyl)thio]cyclohexyl]thio]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[2-(4-hydroxyphenyl)sulfanylcyclohexyl]sulfanylacetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[2-[(4-hydroxyphenyl)thio]cyclohexyl]thio]acetamide Formula: C22H27NO2S2 MolecularWeight: 401.58528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2CCCCC2SC3=CC=C(C=C3)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2CCCCC2SC3=CC=C(C=C3)O

InChI

InChI=1S/C22H27NO2S2/c1-15-6-5-7-16(2)22(15)23-21(25)14-26-19-8-3-4-9-20(19)27-18-12-10-17(24)11-13-18/h5-7,10-13,19-20,24H,3-4,8-9,14H2,1-2H3,(H,23,25)