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

Systemtic Name: ethyl 5-[[1-[(4-bromanylpyrazol-1-yl)methyl]pyrazol-3-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[[1-[(4-bromo-1-pyrazolyl)methyl]-3-pyrazolyl]-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[[1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H18BrN7O3 MolecularWeight: 484.30602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C20H18BrN7O3/c1-2-31-20(30)16-11-23-28(15-6-4-3-5-7-15)18(16)24-19(29)17-8-9-26(25-17)13-27-12-14(21)10-22-27/h3-12H,2,13H2,1H3,(H,24,29)