ethyl 4-oxidanylidene-5-(2-phenoxyethanoylamino)-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5-(2-phenoxyethanoylamino)-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 4-oxo-5-[(2-phenoxyacetyl)amino]-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 4-oxo-5-[(1-oxo-2-phenoxyethyl)amino]-3-phenyl-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-5-[(2-phenoxyacetyl)amino]-3-phenylthieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 4-keto-5-[(2-phenoxyacetyl)amino]-3-phenyl-thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)COC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)COC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O5S/c1-2-30-23(29)20-17-14-32-21(24-18(27)13-31-16-11-7-4-8-12-16)19(17)22(28)26(25-20)15-9-5-3-6-10-15/h3-12,14H,2,13H2,1H3,(H,24,27)