3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[1-[(2-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-(2-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]propionamide Formula: C18H18BrFN6O3 MolecularWeight: 465.276323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2F)C)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2F)C)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C18H18BrFN6O3/c1-11-17(12(2)25(22-11)9-13-5-3-4-6-15(13)20)21-16(27)7-8-24-10-14(19)18(23-24)26(28)29/h3-6,10H,7-9H2,1-2H3,(H,21,27)