2-[(4-bromophenyl)methylsulfanyl]-3-(furan-2-ylmethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(furan-2-ylmethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(2-furylmethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-3-(2-furanylmethyl)-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-3-(furan-2-ylmethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-3-(2-furfuryl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H17BrN2O2S2 MolecularWeight: 461.39518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)Br)CC4=CC=CO4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)Br)CC4=CC=CO4)C

InChI

InChI=1S/C20H17BrN2O2S2/c1-12-13(2)27-18-17(12)19(24)23(10-16-4-3-9-25-16)20(22-18)26-11-14-5-7-15(21)8-6-14/h3-9H,10-11H2,1-2H3