2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanyl-N-hexyl-ethanamide

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanyl-N-hexyl-ethanamide Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanyl-N-hexyl-acetamide CAS Name: 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]-N-hexylacetamide IUPAC Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanyl-N-hexylacetamide Traditional Name: 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]-N-hexyl-acetamide Formula: C23H29N3OS2 MolecularWeight: 427.62586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=CC=CC(=C1C)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCCCCNC(=O)CSC1=CC=CC(=C1C)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C23H29N3OS2/c1-3-4-5-8-14-24-22(27)16-28-21-13-9-10-18(17(21)2)15-29-23-25-19-11-6-7-12-20(19)26-23/h6-7,9-13H,3-5,8,14-16H2,1-2H3,(H,24,27)(H,25,26)