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

Systemtic Name: 3-[4-bromanyl-2-(trifluoromethyl)phenyl]sulfanyl-N,N-diethyl-pyrazole-1-carboxamide Openeye Name: 3-[4-bromo-2-(trifluoromethyl)phenyl]sulfanyl-N,N-diethyl-pyrazole-1-carboxamide CAS Name: 3-[[4-bromo-2-(trifluoromethyl)phenyl]thio]-N,N-diethyl-1-pyrazolecarboxamide IUPAC Name: 3-[4-bromo-2-(trifluoromethyl)phenyl]sulfanyl-N,N-diethylpyrazole-1-carboxamide Traditional Name: 3-[[4-bromo-2-(trifluoromethyl)phenyl]thio]-N,N-diethyl-pyrazole-1-carboxamide Formula: C15H15BrF3N3OS MolecularWeight: 422.26331

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=CC(=N1)SC2=C(C=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

CCN(CC)C(=O)N1C=CC(=N1)SC2=C(C=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C15H15BrF3N3OS/c1-3-21(4-2)14(23)22-8-7-13(20-22)24-12-6-5-10(16)9-11(12)15(17,18)19/h5-9H,3-4H2,1-2H3