4-[1-ethyl-6-oxidanylidene-3-phenyl-5-(pyridin-3-ylamino)pyridazin-4-yl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[1-ethyl-6-oxidanylidene-3-phenyl-5-(pyridin-3-ylamino)pyridazin-4-yl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[1-ethyl-6-oxo-3-phenyl-5-(3-pyridylamino)pyridazin-4-yl]thiazole-2-carboxylic acid CAS Name: 4-[1-ethyl-6-oxo-3-phenyl-5-(3-pyridinylamino)-4-pyridazinyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[1-ethyl-6-oxo-3-phenyl-5-(pyridin-3-ylamino)pyridazin-4-yl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[1-ethyl-6-keto-3-phenyl-5-(3-pyridylamino)pyridazin-4-yl]thiazole-2-carboxylic acid Formula: C21H17N5O3S MolecularWeight: 419.45638

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CSC(=N3)C(=O)O)NC4=CN=CC=C4

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CSC(=N3)C(=O)O)NC4=CN=CC=C4

InChI

InChI=1S/C21H17N5O3S/c1-2-26-20(27)18(23-14-9-6-10-22-11-14)16(15-12-30-19(24-15)21(28)29)17(25-26)13-7-4-3-5-8-13/h3-12,23H,2H2,1H3,(H,28,29)