4-[methylsulfanyl(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC(C1=CC=C(C=C1)C#N)C2=NC=NN2

Isomeric SMILES

CSC(C1=CC=C(C=C1)C#N)C2=NC=NN2

InChI

InChI=1S/C11H10N4S/c1-16-10(11-13-7-14-15-11)9-4-2-8(6-12)3-5-9/h2-5,7,10H,1H3,(H,13,14,15)