2-(3-methylsulfanyl-5-oxidanylidene-1H-1,2,4-triazol-2-yl)propanenitrile

Systemtic Name: 2-(3-methylsulfanyl-5-oxidanylidene-1H-1,2,4-triazol-2-yl)propanenitrile Openeye Name: 2-(3-methylsulfanyl-5-oxo-1H-1,2,4-triazol-2-yl)propanenitrile CAS Name: 2-[3-(methylthio)-5-oxo-1H-1,2,4-triazol-2-yl]propanenitrile IUPAC Name: 2-(3-methylsulfanyl-5-oxo-1H-1,2,4-triazol-2-yl)propanenitrile Traditional Name: 2-[5-keto-3-(methylthio)-1H-1,2,4-triazol-2-yl]propionitrile Formula: C6H8N4OS MolecularWeight: 184.21892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)N1C(=NC(=O)N1)SC

Isomeric SMILES

CC(C#N)N1C(=NC(=O)N1)SC

InChI

InChI=1S/C6H8N4OS/c1-4(3-7)10-6(12-2)8-5(11)9-10/h4H,1-2H3,(H,9,11)