4-bromanyl-2-methyl-N-(3-morpholin-4-ylpropyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-(3-morpholin-4-ylpropyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-(3-morpholinopropyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-[3-(4-morpholinyl)propyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-(3-morpholin-4-ylpropyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-(3-morpholinopropyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C13H18BrF3N4O2 MolecularWeight: 399.20683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NCCCN2CCOCC2

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NCCCN2CCOCC2

InChI

InChI=1S/C13H18BrF3N4O2/c1-20-10(9(14)11(19-20)13(15,16)17)12(22)18-3-2-4-21-5-7-23-8-6-21/h2-8H2,1H3,(H,18,22)