ethyl 2-[[5-bromanyl-2-(3-chloranylpyridin-2-yl)pyrazol-3-yl]carbonylamino]-3-methyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 2-[[5-bromanyl-2-(3-chloranylpyridin-2-yl)pyrazol-3-yl]carbonylamino]-3-methyl-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 2-[[5-bromo-2-(3-chloro-2-pyridyl)pyrazole-3-carbonyl]amino]-3-methyl-cyclohex-2-ene-1-carboxylate CAS Name: 2-[[[5-bromo-2-(3-chloro-2-pyridinyl)-3-pyrazolyl]-oxomethyl]amino]-3-methyl-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-bromo-2-(3-chloropyridin-2-yl)pyrazole-3-carbonyl]amino]-3-methylcyclohex-2-ene-1-carboxylate Traditional Name: 2-[[5-bromo-2-(3-chloro-2-pyridyl)pyrazole-3-carbonyl]amino]-3-methyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C19H20BrClN4O3 MolecularWeight: 467.7441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C

Isomeric SMILES

CCOC(=O)C1CCCC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C

InChI

InChI=1S/C19H20BrClN4O3/c1-3-28-19(27)12-7-4-6-11(2)16(12)23-18(26)14-10-15(20)24-25(14)17-13(21)8-5-9-22-17/h5,8-10,12H,3-4,6-7H2,1-2H3,(H,23,26)