5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-[1,1,2,2,2-pentakis(fluoranyl)ethylsulfanyl]pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-[1,1,2,2,2-pentakis(fluoranyl)ethylsulfanyl]pyrazole-3-carbonitrile Openeye Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(1,1,2,2,2-pentafluoroethylsulfanyl)pyrazole-3-carbonitrile CAS Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(1,1,2,2,2-pentafluoroethylthio)-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(1,1,2,2,2-pentafluoroethylsulfanyl)pyrazole-3-carbonitrile Traditional Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(1,1,2,2,2-pentafluoroethylthio)pyrazole-3-carbonitrile Formula: C13H4Cl2F8N4S MolecularWeight: 471.155886

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)SC(C(F)(F)F)(F)F)N)Cl)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)SC(C(F)(F)F)(F)F)N)Cl)C(F)(F)F

InChI

InChI=1S/C13H4Cl2F8N4S/c14-5-1-4(11(16,17)18)2-6(15)8(5)27-10(25)9(7(3-24)26-27)28-13(22,23)12(19,20)21/h1-2H,25H2