5-azanyl-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbothioamide

Systemtic Name: 5-azanyl-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbothioamide Openeye Name: 5-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbothioamide CAS Name: 5-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-4-pyrazolecarbothioamide IUPAC Name: 5-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-methylpyrazole-4-carbothioamide Traditional Name: 5-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-pyrazole-4-carbothioamide Formula: C12H10ClF3N4S MolecularWeight: 334.74781

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=S)N)N)C2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

CC1=NN(C(=C1C(=S)N)N)C2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C12H10ClF3N4S/c1-5-9(11(18)21)10(17)20(19-5)8-4-6(12(14,15)16)2-3-7(8)13/h2-4H,17H2,1H3,(H2,18,21)