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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

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