N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-methylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-methylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-methyl-acetamide Formula: C13H19N5OS MolecularWeight: 293.38786

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(C)CCC#N)C2CC2

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(C)CCC#N)C2CC2

InChI

InChI=1S/C13H19N5OS/c1-3-18-12(10-5-6-10)15-16-13(18)20-9-11(19)17(2)8-4-7-14/h10H,3-6,8-9H2,1-2H3