5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-ethylsulfonyl-pyrazole-3-carbothioamide

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-ethylsulfonyl-pyrazole-3-carbothioamide Openeye Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethylsulfonyl-pyrazole-3-carbothioamide CAS Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethylsulfonyl-3-pyrazolecarbothioamide IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethylsulfonylpyrazole-3-carbothioamide Traditional Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-esyl-pyrazole-3-carbothioamide Formula: C13H11Cl2F3N4O2S2 MolecularWeight: 447.28325

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(N(N=C1C(=S)N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N

Isomeric SMILES

CCS(=O)(=O)C1=C(N(N=C1C(=S)N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N

InChI

InChI=1S/C13H11Cl2F3N4O2S2/c1-2-26(23,24)10-8(12(20)25)21-22(11(10)19)9-6(14)3-5(4-7(9)15)13(16,17)18/h3-4H,2,19H2,1H3,(H2,20,25)