ethyl 4-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]amino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]amino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[[4-(2-ethoxy-2-oxo-ethyl)thiazol-2-yl]amino]-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-[[4-(2-ethoxy-2-oxoethyl)-2-thiazolyl]amino]-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]amino]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[[4-(2-ethoxy-2-keto-ethyl)thiazol-2-yl]amino]-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N4O5S/c1-4-29-18(27)10-14-12-31-21(22-14)23-16-11-17(26)25(15-8-6-13(3)7-9-15)24-19(16)20(28)30-5-2/h6-9,11-12H,4-5,10H2,1-3H3,(H,22,23)