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

Systemtic Name: phenethyl 5-methyl-4-oxidanylidene-3-(2-phenoxyethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 5-methyl-4-oxo-3-(2-phenoxyethyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(2-phenoxyethyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 5-methyl-4-oxo-3-(2-phenoxyethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-(2-phenoxyethyl)thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCOC3=CC=CC=C3)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCOC3=CC=CC=C3)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O4S/c1-17-20-22(31-21(17)24(28)30-14-12-18-8-4-2-5-9-18)25-16-26(23(20)27)13-15-29-19-10-6-3-7-11-19/h2-11,16H,12-15H2,1H3