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

Systemtic Name: propan-2-yl 3-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 3-[2-(2-ethyl-6-methyl-anilino)-1-methyl-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(2-ethyl-6-methyl-anilino)-2-keto-1-methyl-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C)N2C=NC3=C(C2=O)C(=C(S3)C(=O)OC(C)C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C)N2C=NC3=C(C2=O)C(=C(S3)C(=O)OC(C)C)C)C

InChI

InChI=1S/C23H27N3O4S/c1-7-16-10-8-9-13(4)18(16)25-20(27)15(6)26-11-24-21-17(22(26)28)14(5)19(31-21)23(29)30-12(2)3/h8-12,15H,7H2,1-6H3,(H,25,27)