4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzenecarbonitrile

Systemtic Name: 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzenecarbonitrile Openeye Name: 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzonitrile CAS Name: 4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzonitrile IUPAC Name: 4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzonitrile Traditional Name: 4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzonitrile Formula: C10H8N4S MolecularWeight: 216.26232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC=NN2)C#N

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC=NN2)C#N

InChI

InChI=1S/C10H8N4S/c11-5-8-1-3-9(4-2-8)6-15-10-12-7-13-14-10/h1-4,7H,6H2,(H,12,13,14)