(4-methoxycarbonylphenyl)methyl 1-ethyl-6-oxidanylidene-5-(pyridin-3-ylamino)-3-thiophen-2-yl-pyridazine-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 1-ethyl-6-oxidanylidene-5-(pyridin-3-ylamino)-3-thiophen-2-yl-pyridazine-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl 1-ethyl-6-oxo-5-(3-pyridylamino)-3-(2-thienyl)pyridazine-4-carboxylate CAS Name: 1-ethyl-6-oxo-5-(3-pyridinylamino)-3-thiophen-2-yl-4-pyridazinecarboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 1-ethyl-6-oxo-5-(pyridin-3-ylamino)-3-thiophen-2-ylpyridazine-4-carboxylate Traditional Name: 1-ethyl-6-keto-5-(3-pyridylamino)-3-(2-thienyl)pyridazine-4-carboxylic acid (4-carbomethoxybenzyl) ester Formula: C25H22N4O5S MolecularWeight: 490.53098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=CS2)C(=O)OCC3=CC=C(C=C3)C(=O)OC)NC4=CN=CC=C4

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=CS2)C(=O)OCC3=CC=C(C=C3)C(=O)OC)NC4=CN=CC=C4

InChI

InChI=1S/C25H22N4O5S/c1-3-29-23(30)22(27-18-6-4-12-26-14-18)20(21(28-29)19-7-5-13-35-19)25(32)34-15-16-8-10-17(11-9-16)24(31)33-2/h4-14,27H,3,15H2,1-2H3