ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-(2-thiophen-2-ylethanoylamino)pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-(2-thiophen-2-ylethanoylamino)pyridazine-3-carboxylate Openeye Name: ethyl 6-oxo-1-(p-tolyl)-4-[[2-(2-thienyl)acetyl]amino]pyridazine-3-carboxylate CAS Name: 1-(4-methylphenyl)-6-oxo-4-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)-6-oxo-4-[(2-thiophen-2-ylacetyl)amino]pyridazine-3-carboxylate Traditional Name: 6-keto-1-(p-tolyl)-4-[[2-(2-thienyl)acetyl]amino]pyridazine-3-carboxylic acid ethyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H19N3O4S/c1-3-27-20(26)19-16(21-17(24)11-15-5-4-10-28-15)12-18(25)23(22-19)14-8-6-13(2)7-9-14/h4-10,12H,3,11H2,1-2H3,(H,21,24)