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

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C24H23BrN6O4 MolecularWeight: 539.38122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C24H23BrN6O4/c1-14-5-6-15(2)22(9-14)35-20-11-18(10-19(12-20)31(33)34)26-24(32)21-7-8-29(28-21)13-30-17(4)23(25)16(3)27-30/h5-12H,13H2,1-4H3,(H,26,32)