2-[(4-tert-butylphenyl)methylsulfanyl]-5-ethyl-3-(4-methoxy-2-methyl-phenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-ethyl-3-(4-methoxy-2-methyl-phenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-ethyl-3-(4-methoxy-2-methyl-phenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-5-ethyl-3-(4-methoxy-2-methylphenyl)-6-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-ethyl-3-(4-methoxy-2-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-5-ethyl-3-(4-methoxy-2-methyl-phenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C28H32N2O2S2 MolecularWeight: 492.69588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C(C)(C)C)C4=C(C=C(C=C4)OC)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=C(C=C3)C(C)(C)C)C4=C(C=C(C=C4)OC)C)C

InChI

InChI=1S/C28H32N2O2S2/c1-8-22-18(3)34-25-24(22)26(31)30(23-14-13-21(32-7)15-17(23)2)27(29-25)33-16-19-9-11-20(12-10-19)28(4,5)6/h9-15H,8,16H2,1-7H3