2-[(4-methylphenyl)methylsulfanylmethyl]-1H-benzimidazole

Systemtic Name: 2-[(4-methylphenyl)methylsulfanylmethyl]-1H-benzimidazole Openeye Name: 2-(p-tolylmethylsulfanylmethyl)-1H-benzimidazole CAS Name: 2-[[(4-methylphenyl)methylthio]methyl]-1H-benzimidazole IUPAC Name: 2-[(4-methylphenyl)methylsulfanylmethyl]-1H-benzimidazole Traditional Name: 2-[[(4-methylbenzyl)thio]methyl]-1H-benzimidazole Formula: C16H16N2S MolecularWeight: 268.37664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)CSCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H16N2S/c1-12-6-8-13(9-7-12)10-19-11-16-17-14-4-2-3-5-15(14)18-16/h2-9H,10-11H2,1H3,(H,17,18)