N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[4-bromo-1-(4-fluorobenzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C17H16BrFN6O3 MolecularWeight: 451.249743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN(C=C1Br)CC2=CC=C(C=C2)F)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=NN(C=C1Br)CC2=CC=C(C=C2)F)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H16BrFN6O3/c1-2-15(24-9-13(7-20-24)25(27)28)17(26)21-16-14(18)10-23(22-16)8-11-3-5-12(19)6-4-11/h3-7,9-10,15H,2,8H2,1H3,(H,21,22,26)