4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenecarbonitrile

Systemtic Name: 4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenecarbonitrile Openeye Name: 4-(5-thioxo-1H-1,2,4-triazol-4-yl)benzonitrile CAS Name: 4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzonitrile IUPAC Name: 4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzonitrile Traditional Name: 4-(5-thioxo-1H-1,2,4-triazol-4-yl)benzonitrile Formula: C9H6N4S MolecularWeight: 202.23574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N2C=NNC2=S

Isomeric SMILES

C1=CC(=CC=C1C#N)N2C=NNC2=S

InChI

InChI=1S/C9H6N4S/c10-5-7-1-3-8(4-2-7)13-6-11-12-9(13)14/h1-4,6H,(H,12,14)