N-[4,4-bis(bromanyl)-5-oxidanylidene-1-phenyl-pyrazol-3-yl]-2-methyl-propanamide

Systemtic Name: N-[4,4-bis(bromanyl)-5-oxidanylidene-1-phenyl-pyrazol-3-yl]-2-methyl-propanamide Openeye Name: N-(4,4-dibromo-5-oxo-1-phenyl-pyrazol-3-yl)-2-methyl-propanamide CAS Name: N-(4,4-dibromo-5-oxo-1-phenyl-3-pyrazolyl)-2-methylpropanamide IUPAC Name: N-(4,4-dibromo-5-oxo-1-phenylpyrazol-3-yl)-2-methylpropanamide Traditional Name: N-(4,4-dibromo-5-keto-1-phenyl-2-pyrazolin-3-yl)-2-methyl-propionamide Formula: C13H13Br2N3O2 MolecularWeight: 403.06922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NN(C(=O)C1(Br)Br)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC1=NN(C(=O)C1(Br)Br)C2=CC=CC=C2

InChI

InChI=1S/C13H13Br2N3O2/c1-8(2)10(19)16-11-13(14,15)12(20)18(17-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,16,17,19)