ethyl 4,5-dimethyl-2-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(1-oxophthalazin-2-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(1-ketophthalazin-2-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=O)C3=CC=CC=C3C=N2

InChI

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