[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl] 2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: [2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl] 2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl] 2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-tert-butyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl] 2-tert-butyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-tert-butyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethyl] ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)OCC(=O)C3=C(C(=C(N3)C)C(=O)C)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)OCC(=O)C3=C(C(=C(N3)C)C(=O)C)C

InChI

InChI=1S/C23H27N3O4S/c1-10-16(14(5)27)12(3)24-18(10)15(28)9-30-21(29)19-11(2)17-13(4)25-22(23(6,7)8)26-20(17)31-19/h24H,9H2,1-8H3