ethyl 2-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1-oxidanylidene-phthalazin-2-yl]methyl]-5-methyl-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1-oxidanylidene-phthalazin-2-yl]methyl]-5-methyl-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[4-(2-ethoxy-2-oxo-ethyl)-1-oxo-phthalazin-2-yl]methyl]-5-methyl-thiazole-4-carboxylate CAS Name: 2-[[4-(2-ethoxy-2-oxoethyl)-1-oxo-2-phthalazinyl]methyl]-5-methyl-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2-ethoxy-2-oxoethyl)-1-oxophthalazin-2-yl]methyl]-5-methyl-1,3-thiazole-4-carboxylate Traditional Name: 2-[[4-(2-ethoxy-2-keto-ethyl)-1-keto-phthalazin-2-yl]methyl]-5-methyl-thiazole-4-carboxylic acid ethyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=NC(=C(S3)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=NC(=C(S3)C)C(=O)OCC

InChI

InChI=1S/C20H21N3O5S/c1-4-27-17(24)10-15-13-8-6-7-9-14(13)19(25)23(22-15)11-16-21-18(12(3)29-16)20(26)28-5-2/h6-9H,4-5,10-11H2,1-3H3