2-[[2-methyl-3-(2-methylpropylsulfanyl)phenyl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[2-methyl-3-(2-methylpropylsulfanyl)phenyl]methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[(3-isobutylsulfanyl-2-methyl-phenyl)methylsulfanyl]-1H-benzimidazole CAS Name: 2-[[2-methyl-3-(2-methylpropylthio)phenyl]methylthio]-1H-benzimidazole IUPAC Name: 2-[[2-methyl-3-(2-methylpropylsulfanyl)phenyl]methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[[3-(isobutylthio)-2-methyl-benzyl]thio]-1H-benzimidazole Formula: C19H22N2S2 MolecularWeight: 342.52138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCC(C)C)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C=CC=C1SCC(C)C)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H22N2S2/c1-13(2)11-22-18-10-6-7-15(14(18)3)12-23-19-20-16-8-4-5-9-17(16)21-19/h4-10,13H,11-12H2,1-3H3,(H,20,21)