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

Systemtic Name: 3-[(3-phenoxyphenyl)methyl]-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-isopropylphenyl)-3-[(3-phenoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(3-phenoxyphenyl)methyl]-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(3-phenoxyphenyl)methyl]-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-p-cumenyl-3-(3-phenoxybenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C28H24N2O2S MolecularWeight: 452.56736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24N2O2S/c1-19(2)21-11-13-22(14-12-21)25-17-33-27-26(25)28(31)30(18-29-27)16-20-7-6-10-24(15-20)32-23-8-4-3-5-9-23/h3-15,17-19H,16H2,1-2H3