2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-benzimidazole

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-benzimidazole Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-benzimidazole CAS Name: 2-[[(2,5-dimethylphenyl)methylthio]methyl]-1H-benzimidazole IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-benzimidazole Traditional Name: 2-[[(2,5-dimethylbenzyl)thio]methyl]-1H-benzimidazole Formula: C17H18N2S MolecularWeight: 282.40322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2S/c1-12-7-8-13(2)14(9-12)10-20-11-17-18-15-5-3-4-6-16(15)19-17/h3-9H,10-11H2,1-2H3,(H,18,19)