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

Systemtic Name: 5-(4-tert-butylphenyl)-2-[(2-fluorophenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-tert-butylphenyl)-2-[(2-fluorophenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-tert-butylphenyl)-2-[(2-fluorophenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-tert-butylphenyl)-2-[(2-fluorophenyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-tert-butylphenyl)-2-(2-fluorobenzyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H21FN2OS MolecularWeight: 392.489043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21FN2OS/c1-23(2,3)16-10-8-14(9-11-16)17-13-28-22-20(17)21(27)25-19(26-22)12-15-6-4-5-7-18(15)24/h4-11,13H,12H2,1-3H3,(H,25,26,27)