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

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanoethyl)acetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(2-cyanoethyl)acetamide Formula: C11H17N5O2S MolecularWeight: 283.34998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NCCC#N

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NCCC#N

InChI

InChI=1S/C11H17N5O2S/c1-2-3-7-16-10(18)14-15-11(16)19-8-9(17)13-6-4-5-12/h2-4,6-8H2,1H3,(H,13,17)(H,14,18)