dimethyl 3-methyl-5-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(3-methyl-4-oxo-phthalazine-1-carbonyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[(3-methyl-4-oxo-1-phthalazinyl)-oxomethoxy]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(3-methyl-4-oxophthalazine-1-carbonyl)oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-keto-3-methyl-phthalazine-1-carbonyl)oxyacetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H19N3O8S MolecularWeight: 473.45586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C(=O)OC

InChI

InChI=1S/C21H19N3O8S/c1-10-14(19(27)30-3)17(33-16(10)21(29)31-4)22-13(25)9-32-20(28)15-11-7-5-6-8-12(11)18(26)24(2)23-15/h5-8H,9H2,1-4H3,(H,22,25)