(2-ethoxy-2-oxidanylidene-ethyl) 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-3-thiophen-3-yl-pyridazine-4-carboxylate

Systemtic Name: (2-ethoxy-2-oxidanylidene-ethyl) 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxidanylidene-3-thiophen-3-yl-pyridazine-4-carboxylate Openeye Name: (2-ethoxy-2-oxo-ethyl) 1-ethyl-5-(4-isoquinolylamino)-6-oxo-3-(3-thienyl)pyridazine-4-carboxylate CAS Name: 1-ethyl-5-(4-isoquinolinylamino)-6-oxo-3-(3-thiophenyl)-4-pyridazinecarboxylic acid (2-ethoxy-2-oxoethyl) ester IUPAC Name: (2-ethoxy-2-oxoethyl) 1-ethyl-5-(isoquinolin-4-ylamino)-6-oxo-3-thiophen-3-ylpyridazine-4-carboxylate Traditional Name: 1-ethyl-5-(4-isoquinolylamino)-6-keto-3-(3-thienyl)pyridazine-4-carboxylic acid (2-ethoxy-2-keto-ethyl) ester Formula: C24H22N4O5S MolecularWeight: 478.52028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N4O5S/c1-3-28-23(30)22(26-18-12-25-11-15-7-5-6-8-17(15)18)20(21(27-28)16-9-10-34-14-16)24(31)33-13-19(29)32-4-2/h5-12,14,26H,3-4,13H2,1-2H3