2,5-bis(fluoranyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzenecarbonitrile

Systemtic Name: 2,5-bis(fluoranyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzenecarbonitrile Openeye Name: 2,5-difluoro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzonitrile CAS Name: 2,5-difluoro-4-(1H-1,2,4-triazol-5-ylthio)benzonitrile IUPAC Name: 2,5-difluoro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzonitrile Traditional Name: 2,5-difluoro-4-(1H-1,2,4-triazol-5-ylthio)benzonitrile Formula: C9H4F2N4S MolecularWeight: 238.216666

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1F)SC2=NC=NN2)F)C#N

Isomeric SMILES

C1=C(C(=CC(=C1F)SC2=NC=NN2)F)C#N

InChI

InChI=1S/C9H4F2N4S/c10-6-2-8(7(11)1-5(6)3-12)16-9-13-4-14-15-9/h1-2,4H,(H,13,14,15)