3-(1,3-benzodioxol-5-ylmethyl)-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-(1,3-benzodioxol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-3-(1,3-benzodioxol-5-ylmethyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-3-(1,3-benzodioxol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-3-piperonyl-thieno[3,2-d]pyrimidin-4-one Formula: C24H20N2O5S2 MolecularWeight: 480.556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)SC=C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)SC=C3

InChI

InChI=1S/C24H20N2O5S2/c1-14(27)16-4-6-19(29-2)17(10-16)12-33-24-25-18-7-8-32-22(18)23(28)26(24)11-15-3-5-20-21(9-15)31-13-30-20/h3-10H,11-13H2,1-2H3