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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[3-[(3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]-2-furamide Formula: C21H19BrN6O4 MolecularWeight: 499.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC(=CC=C2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC(=CC=C2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)C

InChI

InChI=1S/C21H19BrN6O4/c1-13-8-14(2)27(24-13)10-15-4-3-5-16(9-15)23-21(29)19-7-6-17(32-19)11-26-12-18(22)20(25-26)28(30)31/h3-9,12H,10-11H2,1-2H3,(H,23,29)