4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]benzonitrile IUPAC Name: 4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]benzonitrile Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C13H14N4S/c1-3-17-10(2)15-16-13(17)18-9-12-6-4-11(8-14)5-7-12/h4-7H,3,9H2,1-2H3