2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1H-benzimidazole

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1H-benzimidazole Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1H-benzimidazole CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1H-benzimidazole IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1H-benzimidazole Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1H-benzimidazole Formula: C13H12N4S MolecularWeight: 256.32618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C13H12N4S/c1-8-7-9(2)15-12(14-8)18-13-16-10-5-3-4-6-11(10)17-13/h3-7H,1-2H3,(H,16,17)