ethyl 5-ethyl-2-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[2-(4-keto-3H-phthalazin-1-yl)acetyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32)C(=O)OCC

InChI

InChI=1S/C21H21N3O6S/c1-3-12-9-15(21(28)29-4-2)20(31-12)22-17(25)11-30-18(26)10-16-13-7-5-6-8-14(13)19(27)24-23-16/h5-9H,3-4,10-11H2,1-2H3,(H,22,25)(H,24,27)