5-azanyl-1-[2-chloranyl-6-methoxy-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[2-chloranyl-6-methoxy-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile Openeye Name: 5-amino-1-[2-chloro-6-methoxy-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile CAS Name: 5-amino-1-[2-chloro-6-methoxy-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2-chloro-6-methoxy-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile Traditional Name: 5-amino-1-[2-chloro-6-methoxy-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile Formula: C13H7ClF6N4O2S MolecularWeight: 432.728699

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(F)(F)F)Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(F)(F)F)Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N

InChI

InChI=1S/C13H7ClF6N4O2S/c1-26-8-3-5(12(15,16)17)2-6(14)9(8)24-11(22)10(7(4-21)23-24)27(25)13(18,19)20/h2-3H,22H2,1H3