N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2-cyanoethyl)-N-(2-furylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(2-furanylmethyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2-cyanoethyl)-N-(2-furfuryl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CCC#N)C(=O)CSC2=NC=NN2

Isomeric SMILES

C1=COC(=C1)CN(CCC#N)C(=O)CSC2=NC=NN2

InChI

InChI=1S/C12H13N5O2S/c13-4-2-5-17(7-10-3-1-6-19-10)11(18)8-20-12-14-9-15-16-12/h1,3,6,9H,2,5,7-8H2,(H,14,15,16)