3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzenecarbonitrile

Systemtic Name: 3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzenecarbonitrile Openeye Name: 3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzonitrile CAS Name: 3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]benzonitrile IUPAC Name: 3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)benzonitrile Traditional Name: 3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]benzonitrile Formula: C11H10N4S MolecularWeight: 230.2889

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2=CC=CC(=C2)C#N

Isomeric SMILES

CN1C(=NN=C1SC)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C11H10N4S/c1-15-10(13-14-11(15)16-2)9-5-3-4-8(6-9)7-12/h3-6H,1-2H3