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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C16H14BrFN6O3 MolecularWeight: 437.223163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)Br)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)Br)F)C)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrFN6O3/c1-9-15(24(26)27)10(2)23(20-9)8-22-6-5-14(21-22)16(25)19-13-4-3-11(17)7-12(13)18/h3-7H,8H2,1-2H3,(H,19,25)