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

Systemtic Name: ethyl 5-[[1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[[1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolyl]-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[[1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H22BrN7O3 MolecularWeight: 512.35918

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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)C)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN7O3/c1-4-33-22(32)17-12-24-30(16-8-6-5-7-9-16)20(17)25-21(31)18-10-11-28(27-18)13-29-15(3)19(23)14(2)26-29/h5-12H,4,13H2,1-3H3,(H,25,31)