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

Systemtic Name: 3-[sulfanyl(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile Openeye Name: 3-[sulfanyl(1H-1,2,4-triazol-5-yl)methyl]benzonitrile CAS Name: 3-[mercapto(1H-1,2,4-triazol-5-yl)methyl]benzonitrile IUPAC Name: 3-[sulfanyl(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Traditional Name: 3-[mercapto(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Formula: C10H8N4S MolecularWeight: 216.26232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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