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

Systemtic Name: ethyl 5-methyl-4-(3-methyl-5-propan-2-yl-phenoxy)-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(3-isopropyl-5-methyl-phenoxy)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(3-methyl-5-propan-2-ylphenoxy)-2-[(phenylthio)methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(3-methyl-5-propan-2-ylphenoxy)-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(3-isopropyl-5-methyl-phenoxy)-5-methyl-2-[(phenylthio)methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C27H28N2O3S2 MolecularWeight: 492.65282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CSC3=CC=CC=C3)OC4=CC(=CC(=C4)C(C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CSC3=CC=CC=C3)OC4=CC(=CC(=C4)C(C)C)C)C

InChI

InChI=1S/C27H28N2O3S2/c1-6-31-27(30)24-18(5)23-25(32-20-13-17(4)12-19(14-20)16(2)3)28-22(29-26(23)34-24)15-33-21-10-8-7-9-11-21/h7-14,16H,6,15H2,1-5H3