3-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfanyl-4-cyano-N,N-diethyl-pyrazole-1-carboxamide

Systemtic Name: 3-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfanyl-4-cyano-N,N-diethyl-pyrazole-1-carboxamide Openeye Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]sulfanyl-4-cyano-N,N-diethyl-pyrazole-1-carboxamide CAS Name: 3-[[2-chloro-5-(trifluoromethyl)phenyl]thio]-4-cyano-N,N-diethyl-1-pyrazolecarboxamide IUPAC Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]sulfanyl-4-cyano-N,N-diethylpyrazole-1-carboxamide Traditional Name: 3-[[2-chloro-5-(trifluoromethyl)phenyl]thio]-4-cyano-N,N-diethyl-pyrazole-1-carboxamide Formula: C16H14ClF3N4OS MolecularWeight: 402.82177

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=C(C(=N1)SC2=C(C=CC(=C2)C(F)(F)F)Cl)C#N

Isomeric SMILES

CCN(CC)C(=O)N1C=C(C(=N1)SC2=C(C=CC(=C2)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C16H14ClF3N4OS/c1-3-23(4-2)15(25)24-9-10(8-21)14(22-24)26-13-7-11(16(18,19)20)5-6-12(13)17/h5-7,9H,3-4H2,1-2H3