N-[[4-(1-methylbenzimidazol-2-yl)cyclohexyl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[4-(1-methylbenzimidazol-2-yl)cyclohexyl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[4-(1-methylbenzimidazol-2-yl)cyclohexyl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[4-(1-methyl-2-benzimidazolyl)cyclohexyl]methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[[4-(1-methylbenzimidazol-2-yl)cyclohexyl]methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[[4-(1-methylbenzimidazol-2-yl)cyclohexyl]methyl]-2-(methylthio)nicotinamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C3CCC(CC3)CNC(=O)C4=C(N=CC=C4)SC

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C3CCC(CC3)CNC(=O)C4=C(N=CC=C4)SC

InChI

InChI=1S/C22H26N4OS/c1-26-19-8-4-3-7-18(19)25-20(26)16-11-9-15(10-12-16)14-24-21(27)17-6-5-13-23-22(17)28-2/h3-8,13,15-16H,9-12,14H2,1-2H3,(H,24,27)