4-[[5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]-1-ethyl-N-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-[[5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]-1-ethyl-N-methyl-pyrazole-3-carboxamide Openeye Name: 4-[[5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]furan-2-carbonyl]amino]-1-ethyl-N-methyl-pyrazole-3-carboxamide CAS Name: 4-[[[5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]-1-ethyl-N-methyl-3-pyrazolecarboxamide IUPAC Name: 4-[[5-[(4-bromo-3-nitropyrazol-1-yl)methyl]furan-2-carbonyl]amino]-1-ethyl-N-methylpyrazole-3-carboxamide Traditional Name: 4-[[5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-2-furoyl]amino]-1-ethyl-N-methyl-pyrazole-3-carboxamide Formula: C16H16BrN7O5 MolecularWeight: 466.24614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC)NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC)NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H16BrN7O5/c1-3-22-8-11(13(20-22)16(26)18-2)19-15(25)12-5-4-9(29-12)6-23-7-10(17)14(21-23)24(27)28/h4-5,7-8H,3,6H2,1-2H3,(H,18,26)(H,19,25)