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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-homoveratryl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H20N2O3S/c1-26-18-9-8-15(12-19(18)27-2)10-11-24-14-23-21-20(22(24)25)17(13-28-21)16-6-4-3-5-7-16/h3-9,12-14H,10-11H2,1-2H3