3-(3,4-dimethylphenyl)-5-ethyl-2-(2-hydroxyethylsulfanyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-(2-hydroxyethylsulfanyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-(2-hydroxyethylsulfanyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-(2-hydroxyethylthio)-6-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-(2-hydroxyethylsulfanyl)-6-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-(2-hydroxyethylthio)-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCCO)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCCO)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C19H22N2O2S2/c1-5-15-13(4)25-17-16(15)18(23)21(19(20-17)24-9-8-22)14-7-6-11(2)12(3)10-14/h6-7,10,22H,5,8-9H2,1-4H3