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

Systemtic Name: (phenylmethyl) 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O3/c1-3-24-19(25)16(22-18-12-21-10-9-14(18)2)11-17(23-24)20(26)27-13-15-7-5-4-6-8-15/h4-12,22H,3,13H2,1-2H3