2-[(4-ethyl-5,5-dimethyl-3-methylsulfanyl-1,2,4-triazol-1-yl)methylidene]propanedinitrile

Systemtic Name: 2-[(4-ethyl-5,5-dimethyl-3-methylsulfanyl-1,2,4-triazol-1-yl)methylidene]propanedinitrile Openeye Name: 2-[(4-ethyl-5,5-dimethyl-3-methylsulfanyl-1,2,4-triazol-1-yl)methylene]propanedinitrile CAS Name: 2-[[4-ethyl-5,5-dimethyl-3-(methylthio)-1,2,4-triazol-1-yl]methylidene]propanedinitrile IUPAC Name: 2-[(4-ethyl-5,5-dimethyl-3-methylsulfanyl-1,2,4-triazol-1-yl)methylidene]propanedinitrile Traditional Name: 2-[[4-ethyl-5,5-dimethyl-3-(methylthio)-1,2,4-triazol-1-yl]methylene]malononitrile Formula: C11H15N5S MolecularWeight: 249.3353

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1(C)C)C=C(C#N)C#N)SC

Isomeric SMILES

CCN1C(=NN(C1(C)C)C=C(C#N)C#N)SC

InChI

InChI=1S/C11H15N5S/c1-5-15-10(17-4)14-16(11(15,2)3)8-9(6-12)7-13/h8H,5H2,1-4H3