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

Systemtic Name: (phenylmethyl) 1-ethyl-6-oxidanylidene-5-(pyridin-3-ylamino)-3-thiophen-2-yl-pyridazine-4-carboxylate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4O3S/c1-2-27-22(28)21(25-17-10-6-12-24-14-17)19(20(26-27)18-11-7-13-31-18)23(29)30-15-16-8-4-3-5-9-16/h3-14,25H,2,15H2,1H3