ethyl 4-[2-(4-bromophenyl)ethanoylamino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[2-(4-bromophenyl)ethanoylamino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[[2-(4-bromophenyl)acetyl]amino]-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-[[2-(4-bromophenyl)-1-oxoethyl]amino]-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-bromophenyl)acetyl]amino]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[[2-(4-bromophenyl)acetyl]amino]-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C22H20BrN3O4 MolecularWeight: 470.3159

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC=C(C=C2)Br)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC=C(C=C2)Br)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H20BrN3O4/c1-3-30-22(29)21-18(24-19(27)12-15-6-8-16(23)9-7-15)13-20(28)26(25-21)17-10-4-14(2)5-11-17/h4-11,13H,3,12H2,1-2H3,(H,24,27)