2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-ethynyl-5-methylsulfanyl-pyrazol-3-amine

Systemtic Name: 2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-ethynyl-5-methylsulfanyl-pyrazol-3-amine Openeye Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethynyl-5-methylsulfanyl-pyrazol-3-amine CAS Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethynyl-5-(methylthio)-3-pyrazolamine IUPAC Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethynyl-5-methylsulfanylpyrazol-3-amine Traditional Name: [2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-ethynyl-5-(methylthio)pyrazol-3-yl]amine Formula: C13H8Cl2F3N3S MolecularWeight: 366.18893

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C#C)N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

Isomeric SMILES

CSC1=NN(C(=C1C#C)N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

InChI

InChI=1S/C13H8Cl2F3N3S/c1-3-7-11(19)21(20-12(7)22-2)10-8(14)4-6(5-9(10)15)13(16,17)18/h1,4-5H,19H2,2H3