ethyl 5-ethyl-2-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(1-ketophthalazin-2-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2C(=O)C3=CC=CC=C3C=N2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2C(=O)C3=CC=CC=C3C=N2)C(=O)OCC

InChI

InChI=1S/C19H19N3O4S/c1-3-13-9-15(19(25)26-4-2)17(27-13)21-16(23)11-22-18(24)14-8-6-5-7-12(14)10-20-22/h5-10H,3-4,11H2,1-2H3,(H,21,23)