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

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[3-(2-methylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[3-(2-methylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C23H21BrN6O4 MolecularWeight: 525.35464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C23H21BrN6O4/c1-14-6-4-5-7-21(14)34-19-11-17(10-18(12-19)30(32)33)25-23(31)20-8-9-28(27-20)13-29-16(3)22(24)15(2)26-29/h4-12H,13H2,1-3H3,(H,25,31)