N-(1H-benzimidazol-2-ylmethyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NCC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NCC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C16H17N5OS/c1-10-7-11(2)19-16(18-10)23-9-15(22)17-8-14-20-12-5-3-4-6-13(12)21-14/h3-7H,8-9H2,1-2H3,(H,17,22)(H,20,21)