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

Systemtic Name: (3-cyanophenyl)methyl 4-ethanoyl-1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: (3-cyanophenyl)methyl 4-acetyl-1-ethyl-5-[(4-methyl-3-pyridyl)amino]-6-oxo-pyridazine-3-carboxylate CAS Name: 4-acetyl-1-ethyl-5-[(4-methyl-3-pyridinyl)amino]-6-oxo-3-pyridazinecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 4-acetyl-1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxopyridazine-3-carboxylate Traditional Name: 4-acetyl-1-ethyl-6-keto-5-[(4-methyl-3-pyridyl)amino]pyridazine-3-carboxylic acid (3-cyanobenzyl) ester Formula: C23H21N5O4 MolecularWeight: 431.44394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O4/c1-4-28-22(30)20(26-18-12-25-9-8-14(18)2)19(15(3)29)21(27-28)23(31)32-13-17-7-5-6-16(10-17)11-24/h5-10,12,26H,4,13H2,1-3H3