3-[2-(4-ethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 3-[2-(4-ethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 3-[2-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 3-[2-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)-2-oxoethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 3-[2-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 3-[2-(4-ethyl-3-keto-1,4-benzoxazin-6-yl)-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C20H17N3O6S MolecularWeight: 427.43048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C(=C(S4)C(=O)O)C

Isomeric SMILES

CCN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C(=C(S4)C(=O)O)C

InChI

InChI=1S/C20H17N3O6S/c1-3-23-12-6-11(4-5-14(12)29-8-15(23)25)13(24)7-22-9-21-18-16(19(22)26)10(2)17(30-18)20(27)28/h4-6,9H,3,7-8H2,1-2H3,(H,27,28)