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

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-cyano-4-nitro-phenyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-cyano-4-nitro-phenyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(2-cyano-4-nitrophenyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-cyano-4-nitrophenyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-cyano-4-nitro-phenyl)-2-furamide Formula: C18H14BrN5O4 MolecularWeight: 444.23886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C)Br

InChI

InChI=1S/C18H14BrN5O4/c1-10-17(19)11(2)23(22-10)9-14-4-6-16(28-14)18(25)21-15-5-3-13(24(26)27)7-12(15)8-20/h3-7H,9H2,1-2H3,(H,21,25)