2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-1H-benzimidazole Openeye Name: 2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-1H-benzimidazole CAS Name: 2-[2-(3,5-dimethylphenoxy)ethylthio]-1H-benzimidazole IUPAC Name: 2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-1H-benzimidazole Traditional Name: 2-[2-(3,5-dimethylphenoxy)ethylthio]-1H-benzimidazole Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C17H18N2OS/c1-12-9-13(2)11-14(10-12)20-7-8-21-17-18-15-5-3-4-6-16(15)19-17/h3-6,9-11H,7-8H2,1-2H3,(H,18,19)