2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocyclohexyl)-N-methyl-ethanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocyclohexyl)-N-methyl-ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocyclohexyl)-N-methyl-acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(1-cyanocyclohexyl)-N-methylacetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocyclohexyl)-N-methylacetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(1-cyanocyclohexyl)-N-methyl-acetamide Formula: C12H18N6OS MolecularWeight: 294.37592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NNC(=N1)N)C2(CCCCC2)C#N

Isomeric SMILES

CN(C(=O)CSC1=NNC(=N1)N)C2(CCCCC2)C#N

InChI

InChI=1S/C12H18N6OS/c1-18(12(8-13)5-3-2-4-6-12)9(19)7-20-11-15-10(14)16-17-11/h2-7H2,1H3,(H3,14,15,16,17)