ethyl 1-[3-[(5-bromanylpyridin-3-yl)carbonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[(5-bromanylpyridin-3-yl)carbonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[(5-bromopyridine-3-carbonyl)amino]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[3-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(5-bromopyridine-3-carbonyl)amino]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[3-[(5-bromonicotinoyl)amino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C19H17BrN4O3 MolecularWeight: 429.26728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=CN=C3)Br)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=CN=C3)Br)C

InChI

InChI=1S/C19H17BrN4O3/c1-3-27-19(26)17-11-22-24(12(17)2)16-6-4-5-15(8-16)23-18(25)13-7-14(20)10-21-9-13/h4-11H,3H2,1-2H3,(H,23,25)