2-[(3,4-dimethoxyphenyl)methyl]-5-(4-phenylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]-5-(4-phenylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3,4-dimethoxyphenyl)methyl]-5-(4-phenylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3,4-dimethoxyphenyl)methyl]-5-(4-phenylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3,4-dimethoxyphenyl)methyl]-5-(4-phenylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-phenylphenyl)-2-veratryl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5)C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5)C(=O)N2)OC

InChI

InChI=1S/C27H22N2O3S/c1-31-22-13-8-17(14-23(22)32-2)15-24-28-26(30)25-21(16-33-27(25)29-24)20-11-9-19(10-12-20)18-6-4-3-5-7-18/h3-14,16H,15H2,1-2H3,(H,28,29,30)