1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(4-methyl-2-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(4-methyl-2-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide Formula: C17H17BrN6O3 MolecularWeight: 433.25928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)Br)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)Br)C)[N+](=O)[O-]

InChI

InChI=1S/C17H17BrN6O3/c1-10-4-5-13(15(8-10)24(26)27)19-17(25)14-6-7-22(21-14)9-23-12(3)16(18)11(2)20-23/h4-8H,9H2,1-3H3,(H,19,25)