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

Systemtic Name: ethyl 4-(2-ethoxyphenoxy)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(2-ethoxyphenoxy)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(2-ethoxyphenoxy)-5-methyl-2-[(phenylthio)methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxyphenoxy)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(2-ethoxyphenoxy)-5-methyl-2-[(phenylthio)methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C25H24N2O4S2 MolecularWeight: 480.59906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=C3C(=C(SC3=NC(=N2)CSC4=CC=CC=C4)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=CC=C1OC2=C3C(=C(SC3=NC(=N2)CSC4=CC=CC=C4)C(=O)OCC)C

InChI

InChI=1S/C25H24N2O4S2/c1-4-29-18-13-9-10-14-19(18)31-23-21-16(3)22(25(28)30-5-2)33-24(21)27-20(26-23)15-32-17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3