2-azanyl-5-iodanyl-4-[2,2,2-tris(fluoranyl)ethylsulfanyl]benzenecarbonitrile

Systemtic Name: 2-azanyl-5-iodanyl-4-[2,2,2-tris(fluoranyl)ethylsulfanyl]benzenecarbonitrile Openeye Name: 2-amino-5-iodo-4-(2,2,2-trifluoroethylsulfanyl)benzonitrile CAS Name: 2-amino-5-iodo-4-(2,2,2-trifluoroethylthio)benzonitrile IUPAC Name: 2-amino-5-iodo-4-(2,2,2-trifluoroethylsulfanyl)benzonitrile Traditional Name: 2-amino-5-iodo-4-(2,2,2-trifluoroethylthio)benzonitrile Formula: C9H6F3IN2S MolecularWeight: 358.12202

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1I)SCC(F)(F)F)N)C#N

Isomeric SMILES

C1=C(C(=CC(=C1I)SCC(F)(F)F)N)C#N

InChI

InChI=1S/C9H6F3IN2S/c10-9(11,12)4-16-8-2-7(15)5(3-14)1-6(8)13/h1-2H,4,15H2