N-[4-(1H-benzimidazol-2-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C21H19N5OS/c1-13-11-14(2)23-21(22-13)28-12-19(27)24-16-9-7-15(8-10-16)20-25-17-5-3-4-6-18(17)26-20/h3-11H,12H2,1-2H3,(H,24,27)(H,25,26)