(2,5-dimethylphenyl)methyl 2,5-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (2,5-dimethylphenyl)methyl 2,5-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (2,5-dimethylphenyl)methyl 2,5-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2,5-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-2,5-dimethyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid (2,5-dimethylbenzyl) ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2=C(C3=C(S2)N=C(NC3=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2=C(C3=C(S2)N=C(NC3=O)C)C

InChI

InChI=1S/C18H18N2O3S/c1-9-5-6-10(2)13(7-9)8-23-18(22)15-11(3)14-16(21)19-12(4)20-17(14)24-15/h5-7H,8H2,1-4H3,(H,19,20,21)