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

Systemtic Name: 5-chloranyl-2-fluoranyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzenecarbonitrile Openeye Name: 5-chloro-2-fluoro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzonitrile CAS Name: 5-chloro-2-fluoro-4-(1H-1,2,4-triazol-5-ylthio)benzonitrile IUPAC Name: 5-chloro-2-fluoro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzonitrile Traditional Name: 5-chloro-2-fluoro-4-(1H-1,2,4-triazol-5-ylthio)benzonitrile Formula: C9H4ClFN4S MolecularWeight: 254.671263

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Cl)SC2=NC=NN2)F)C#N

Isomeric SMILES

C1=C(C(=CC(=C1Cl)SC2=NC=NN2)F)C#N

InChI

InChI=1S/C9H4ClFN4S/c10-6-1-5(3-12)7(11)2-8(6)16-9-13-4-14-15-9/h1-2,4H,(H,13,14,15)