5-(3,4-dimethoxyphenyl)-3-(4-iodophenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-(4-iodophenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(3,4-dimethoxyphenyl)-3-(4-iodophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethoxyphenyl)-3-(4-iodophenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-(4-iodophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3,4-dimethoxyphenyl)-3-(4-iodophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H15IN2O3S MolecularWeight: 490.31417

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C4=CC=C(C=C4)I)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)C4=CC=C(C=C4)I)OC

InChI

InChI=1S/C20H15IN2O3S/c1-25-16-8-3-12(9-17(16)26-2)15-10-27-19-18(15)20(24)23(11-22-19)14-6-4-13(21)5-7-14/h3-11H,1-2H3