(4-bromophenyl)methyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: (4-bromophenyl)methyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: (4-bromophenyl)methyl 1-ethyl-5-[(4-methyl-3-pyridyl)amino]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-ethyl-5-[(4-methyl-3-pyridinyl)amino]-6-oxo-3-pyridazinecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxopyridazine-3-carboxylate Traditional Name: 1-ethyl-6-keto-5-[(4-methyl-3-pyridyl)amino]pyridazine-3-carboxylic acid (4-bromobenzyl) ester Formula: C20H19BrN4O3 MolecularWeight: 443.29386

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC(=N1)C(=O)OCC2=CC=C(C=C2)Br)NC3=C(C=CN=C3)C

Isomeric SMILES

CCN1C(=O)C(=CC(=N1)C(=O)OCC2=CC=C(C=C2)Br)NC3=C(C=CN=C3)C

InChI

InChI=1S/C20H19BrN4O3/c1-3-25-19(26)16(23-18-11-22-9-8-13(18)2)10-17(24-25)20(27)28-12-14-4-6-15(21)7-5-14/h4-11,23H,3,12H2,1-2H3