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

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-pyrrol-1-yl-pyrazole-3-carbothioamide Openeye Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-pyrrol-1-yl-pyrazole-3-carbothioamide CAS Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-(1-pyrrolyl)-3-pyrazolecarbothioamide IUPAC Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-pyrrol-1-ylpyrazole-3-carbothioamide Traditional Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-pyrrol-1-yl-pyrazole-3-carbothioamide Formula: C15H9Cl2F3N4S MolecularWeight: 405.22497

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC(=NN2C3=C(C=C(C=C3Cl)C(F)(F)F)Cl)C(=S)N

Isomeric SMILES

C1=CN(C=C1)C2=CC(=NN2C3=C(C=C(C=C3Cl)C(F)(F)F)Cl)C(=S)N

InChI

InChI=1S/C15H9Cl2F3N4S/c16-9-5-8(15(18,19)20)6-10(17)13(9)24-12(23-3-1-2-4-23)7-11(22-24)14(21)25/h1-7H,(H2,21,25)