6-chloranyl-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methyl-benzimidazol-5-yl]pyridine-3-carboxamide

Systemtic Name: 6-chloranyl-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methyl-benzimidazol-5-yl]pyridine-3-carboxamide Openeye Name: 6-chloro-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methyl-benzimidazol-5-yl]pyridine-3-carboxamide CAS Name: 6-chloro-N-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-methyl-5-benzimidazolyl]-3-pyridinecarboxamide IUPAC Name: 6-chloro-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methylbenzimidazol-5-yl]pyridine-3-carboxamide Traditional Name: 6-chloro-N-[2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1-methyl-benzimidazol-5-yl]nicotinamide Formula: C21H19ClN6OS MolecularWeight: 438.93316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4=CN=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4=CN=C(C=C4)Cl)C

InChI

InChI=1S/C21H19ClN6OS/c1-12-8-13(2)25-21(24-12)30-11-19-27-16-9-15(5-6-17(16)28(19)3)26-20(29)14-4-7-18(22)23-10-14/h4-10H,11H2,1-3H3,(H,26,29)