[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-(2-methoxyphenyl)thiazol-4-yl]methyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid [2-(2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid [2-(2-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4OC

InChI

InChI=1S/C21H17N3O4S/c1-24-20(25)15-8-4-3-7-14(15)18(23-24)21(26)28-11-13-12-29-19(22-13)16-9-5-6-10-17(16)27-2/h3-10,12H,11H2,1-2H3