2-[(2-fluorophenyl)methyl]-5-(4-methoxy-3-methyl-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2-fluorophenyl)methyl]-5-(4-methoxy-3-methyl-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(2-fluorophenyl)methyl]-5-(4-methoxy-3-methyl-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2-fluorophenyl)methyl]-5-(4-methoxy-3-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(2-fluorophenyl)methyl]-5-(4-methoxy-3-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(2-fluorobenzyl)-5-(4-methoxy-3-methyl-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H17FN2O2S MolecularWeight: 380.435283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CSC3=C2C(=O)NC(=N3)CC4=CC=CC=C4F)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CSC3=C2C(=O)NC(=N3)CC4=CC=CC=C4F)OC

InChI

InChI=1S/C21H17FN2O2S/c1-12-9-13(7-8-17(12)26-2)15-11-27-21-19(15)20(25)23-18(24-21)10-14-5-3-4-6-16(14)22/h3-9,11H,10H2,1-2H3,(H,23,24,25)