5-(4-methylphenyl)-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(3-phenoxyphenyl)methyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-3-[(3-phenoxyphenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-phenoxybenzyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C26H20N2O2S MolecularWeight: 424.5142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H20N2O2S/c1-18-10-12-20(13-11-18)23-16-31-25-24(23)26(29)28(17-27-25)15-19-6-5-9-22(14-19)30-21-7-3-2-4-8-21/h2-14,16-17H,15H2,1H3