2-(2,6-dimethylphenyl)sulfanyl-6-imidazol-1-yl-1H-benzimidazole

Systemtic Name: 2-(2,6-dimethylphenyl)sulfanyl-6-imidazol-1-yl-1H-benzimidazole Openeye Name: 2-(2,6-dimethylphenyl)sulfanyl-6-imidazol-1-yl-1H-benzimidazole CAS Name: 2-[(2,6-dimethylphenyl)thio]-6-(1-imidazolyl)-1H-benzimidazole IUPAC Name: 2-(2,6-dimethylphenyl)sulfanyl-6-imidazol-1-yl-1H-benzimidazole Traditional Name: 2-[(2,6-dimethylphenyl)thio]-6-imidazol-1-yl-1H-benzimidazole Formula: C18H16N4S MolecularWeight: 320.41144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)SC2=NC3=C(N2)C=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)SC2=NC3=C(N2)C=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C18H16N4S/c1-12-4-3-5-13(2)17(12)23-18-20-15-7-6-14(10-16(15)21-18)22-9-8-19-11-22/h3-11H,1-2H3,(H,20,21)