3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile

Systemtic Name: 3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Openeye Name: 3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile CAS Name: 3-[(4-methyl-1,2,4-triazol-3-yl)thio]propanenitrile IUPAC Name: 3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Traditional Name: 3-[(4-methyl-1,2,4-triazol-3-yl)thio]propionitrile Formula: C6H8N4S MolecularWeight: 168.21952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCC#N

Isomeric SMILES

CN1C=NN=C1SCCC#N

InChI

InChI=1S/C6H8N4S/c1-10-5-8-9-6(10)11-4-2-3-7/h5H,2,4H2,1H3