diethyl 4-[(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylamino]-1-phenyl-pyrazole-3,5-dicarboxylate

Systemtic Name: diethyl 4-[(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylamino]-1-phenyl-pyrazole-3,5-dicarboxylate Openeye Name: diethyl 4-[(4-bromo-1-ethyl-pyrazole-3-carbonyl)amino]-1-phenyl-pyrazole-3,5-dicarboxylate CAS Name: 4-[[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]amino]-1-phenylpyrazole-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[(4-bromo-1-ethylpyrazole-3-carbonyl)amino]-1-phenylpyrazole-3,5-dicarboxylate Traditional Name: 4-[(4-bromo-1-ethyl-pyrazole-3-carbonyl)amino]-1-phenyl-pyrazole-3,5-dicarboxylic acid diethyl ester Formula: C21H22BrN5O5 MolecularWeight: 504.33388

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=C(N(N=C2C(=O)OCC)C3=CC=CC=C3)C(=O)OCC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=C(N(N=C2C(=O)OCC)C3=CC=CC=C3)C(=O)OCC)Br

InChI

InChI=1S/C21H22BrN5O5/c1-4-26-12-14(22)15(24-26)19(28)23-16-17(20(29)31-5-2)25-27(13-10-8-7-9-11-13)18(16)21(30)32-6-3/h7-12H,4-6H2,1-3H3,(H,23,28)