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

Systemtic Name: ethyl 4-(furan-2-ylmethylsulfanyl)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(2-furylmethylsulfanyl)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(2-furanylmethylthio)-5-methyl-2-[(phenylthio)methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(furan-2-ylmethylsulfanyl)-5-methyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(2-furfurylthio)-5-methyl-2-[(phenylthio)methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H20N2O3S3 MolecularWeight: 456.6008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N=C2SCC3=CC=CO3)CSC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N=C2SCC3=CC=CO3)CSC4=CC=CC=C4)C

InChI

InChI=1S/C22H20N2O3S3/c1-3-26-22(25)19-14(2)18-20(29-12-15-8-7-11-27-15)23-17(24-21(18)30-19)13-28-16-9-5-4-6-10-16/h4-11H,3,12-13H2,1-2H3