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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[(3-phenoxyphenyl)methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-(3-phenoxybenzyl)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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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)OC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC(=CC=C3)OC4=CC=CC=C4)C

InChI

InChI=1S/C23H20N2O4S/c1-3-28-23(27)20-15(2)19-21(30-20)24-14-25(22(19)26)13-16-8-7-11-18(12-16)29-17-9-5-4-6-10-17/h4-12,14H,3,13H2,1-2H3