ethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-3-phenyl-pyridazine-4-carboxylate

Systemtic Name: ethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-3-phenyl-pyridazine-4-carboxylate Openeye Name: ethyl 1-ethyl-5-(4-isoquinolylamino)-6-oxo-3-phenyl-pyridazine-4-carboxylate CAS Name: 1-ethyl-5-(4-isoquinolinylamino)-6-oxo-3-phenyl-4-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxo-3-phenylpyridazine-4-carboxylate Traditional Name: 1-ethyl-5-(4-isoquinolylamino)-6-keto-3-phenyl-pyridazine-4-carboxylic acid ethyl ester Formula: C24H22N4O3 MolecularWeight: 414.45648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C(=O)OCC)NC3=CN=CC4=CC=CC=C43

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C(=O)OCC)NC3=CN=CC4=CC=CC=C43

InChI

InChI=1S/C24H22N4O3/c1-3-28-23(29)22(26-19-15-25-14-17-12-8-9-13-18(17)19)20(24(30)31-4-2)21(27-28)16-10-6-5-7-11-16/h5-15,26H,3-4H2,1-2H3