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

Systemtic Name: 5,6-dimethyl-2-methylsulfanyl-3-(4-phenylmethoxyphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-benzyloxyphenyl)-5,6-dimethyl-2-methylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-(methylthio)-3-(4-phenylmethoxyphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-methylsulfanyl-3-(4-phenylmethoxyphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-benzoxyphenyl)-5,6-dimethyl-2-(methylthio)thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC)C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC)C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C22H20N2O2S2/c1-14-15(2)28-20-19(14)21(25)24(22(23-20)27-3)17-9-11-18(12-10-17)26-13-16-7-5-4-6-8-16/h4-12H,13H2,1-3H3