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

Systemtic Name: propan-2-yl 5-methyl-3-[2-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 5-methyl-3-[2-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2-oxo-ethyl]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[2-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-methyl-3-[2-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2-oxoethyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CN3C=NC4=C(C3=O)C(=C(S4)C(=O)OC(C)C)C

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CN3C=NC4=C(C3=O)C(=C(S4)C(=O)OC(C)C)C

InChI

InChI=1S/C22H21N3O6S/c1-10(2)30-22(29)18-11(3)17-20(32-18)23-9-25(21(17)28)8-15(26)13-5-6-16-14(7-13)24-19(27)12(4)31-16/h5-7,9-10,12H,8H2,1-4H3,(H,24,27)