ethyl 4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonyloxymethyl]-1,3-thiazole-2-carboxylate

Systemtic Name: ethyl 4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonyloxymethyl]-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-[(4-oxo-3-propyl-phthalazine-1-carbonyl)oxymethyl]thiazole-2-carboxylate CAS Name: 4-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methoxy]methyl]-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-oxo-3-propylphthalazine-1-carbonyl)oxymethyl]-1,3-thiazole-2-carboxylate Traditional Name: 4-[(4-keto-3-propyl-phthalazine-1-carbonyl)oxymethyl]thiazole-2-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)C(=O)OCC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)C(=O)OCC

InChI

InChI=1S/C19H19N3O5S/c1-3-9-22-17(23)14-8-6-5-7-13(14)15(21-22)18(24)27-10-12-11-28-16(20-12)19(25)26-4-2/h5-8,11H,3-4,9-10H2,1-2H3