6-methyl-2-(3-methylbutylsulfanyl)-1H-benzimidazole

Systemtic Name: 6-methyl-2-(3-methylbutylsulfanyl)-1H-benzimidazole Openeye Name: 2-isopentylsulfanyl-6-methyl-1H-benzimidazole CAS Name: 6-methyl-2-(3-methylbutylthio)-1H-benzimidazole IUPAC Name: 6-methyl-2-(3-methylbutylsulfanyl)-1H-benzimidazole Traditional Name: 2-(isoamylthio)-6-methyl-1H-benzimidazole Formula: C13H18N2S MolecularWeight: 234.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCCC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCCC(C)C

InChI

InChI=1S/C13H18N2S/c1-9(2)6-7-16-13-14-11-5-4-10(3)8-12(11)15-13/h4-5,8-9H,6-7H2,1-3H3,(H,14,15)