5-azanyl-4-(trifluoromethylsulfanyl)-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-4-(trifluoromethylsulfanyl)-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carbonitrile Openeye Name: 5-amino-1-(2,4,6-trichlorophenyl)-4-(trifluoromethylsulfanyl)pyrazole-3-carbonitrile CAS Name: 5-amino-1-(2,4,6-trichlorophenyl)-4-(trifluoromethylthio)-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2,4,6-trichlorophenyl)-4-(trifluoromethylsulfanyl)pyrazole-3-carbonitrile Traditional Name: 5-amino-1-(2,4,6-trichlorophenyl)-4-(trifluoromethylthio)pyrazole-3-carbonitrile Formula: C11H4Cl3F3N4S MolecularWeight: 387.59547

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H4Cl3F3N4S/c12-4-1-5(13)8(6(14)2-4)21-10(19)9(7(3-18)20-21)22-11(15,16)17/h1-2H,19H2