2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C12H19N5OS MolecularWeight: 281.37716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NN1)SCC(=O)N(C)CCC#N

Isomeric SMILES

CC(C)(C)C1=NC(=NN1)SCC(=O)N(C)CCC#N

InChI

InChI=1S/C12H19N5OS/c1-12(2,3)10-14-11(16-15-10)19-8-9(18)17(4)7-5-6-13/h5,7-8H2,1-4H3,(H,14,15,16)