3-azanyl-4-sulfinyl-2-[2,4,6-tris(chloranyl)phenyl]-3H-pyrazole-5-carbonitrile; bromanyl-chloranyl-fluoranyl-methane

Systemtic Name: 3-azanyl-4-sulfinyl-2-[2,4,6-tris(chloranyl)phenyl]-3H-pyrazole-5-carbonitrile; bromanyl-chloranyl-fluoranyl-methane Openeye Name: 3-amino-4-sulfinyl-2-(2,4,6-trichlorophenyl)-3H-pyrazole-5-carbonitrile; bromo-chloro-fluoro-methane CAS Name: 3-amino-4-sulfinyl-2-(2,4,6-trichlorophenyl)-3H-pyrazole-5-carbonitrile; bromo-chloro-fluoromethane IUPAC Name: 3-amino-4-sulfinyl-2-(2,4,6-trichlorophenyl)-3H-pyrazole-5-carbonitrile; bromo-chloro-fluoromethane Traditional Name: 5-amino-4-sulfinyl-1-(2,4,6-trichlorophenyl)-2-pyrazoline-3-carbonitrile; bromo-chloro-fluoro-methane Formula: C11H6BrCl4FN4OS MolecularWeight: 482.970943

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C(C(=S=O)C(=N2)C#N)N)Cl)Cl.C(F)(Cl)Br

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C(C(=S=O)C(=N2)C#N)N)Cl)Cl.C(F)(Cl)Br

InChI

InChI=1S/C10H5Cl3N4OS.CHBrClF/c11-4-1-5(12)8(6(13)2-4)17-10(15)9(19-18)7(3-14)16-17;2-1(3)4/h1-2,10H,15H2;1H