ethyl 5-methyl-4-oxidanylidene-3-[(3-propan-2-yloxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-[(3-propan-2-yloxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[(3-isopropoxycarbonylphenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[[3-[oxo(propan-2-yloxy)methyl]phenyl]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-[(3-propan-2-yloxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(3-isopropoxycarbonylbenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC(=C3)C(=O)OC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC(=C3)C(=O)OC(C)C)C

InChI

InChI=1S/C21H22N2O5S/c1-5-27-21(26)17-13(4)16-18(29-17)22-11-23(19(16)24)10-14-7-6-8-15(9-14)20(25)28-12(2)3/h6-9,11-12H,5,10H2,1-4H3