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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(5-ethylsulfonyl-2-hydroxy-phenyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(5-ethylsulfonyl-2-hydroxyphenyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(5-ethylsulfonyl-2-hydroxyphenyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(5-esyl-2-hydroxy-phenyl)-2-furamide Formula: C17H15BrN4O7S MolecularWeight: 499.2926

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H15BrN4O7S/c1-2-30(27,28)11-4-5-14(23)13(7-11)19-17(24)15-6-3-10(29-15)8-21-9-12(18)16(20-21)22(25)26/h3-7,9,23H,2,8H2,1H3,(H,19,24)