[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate

Systemtic Name: [2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrazole-3-carboxylate Openeye Name: [2-[(5-bromo-2-pyridyl)amino]-2-oxo-ethyl] 4-chloro-1-methyl-pyrazole-3-carboxylate CAS Name: 4-chloro-1-methyl-3-pyrazolecarboxylic acid [2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-bromopyridin-2-yl)amino]-2-oxoethyl] 4-chloro-1-methylpyrazole-3-carboxylate Traditional Name: 4-chloro-1-methyl-pyrazole-3-carboxylic acid [2-[(5-bromo-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C12H10BrClN4O3 MolecularWeight: 373.5898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)OCC(=O)NC2=NC=C(C=C2)Br)Cl

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OCC(=O)NC2=NC=C(C=C2)Br)Cl

InChI

InChI=1S/C12H10BrClN4O3/c1-18-5-8(14)11(17-18)12(20)21-6-10(19)16-9-3-2-7(13)4-15-9/h2-5H,6H2,1H3,(H,15,16,19)