3-[(4-tert-butylphenyl)methyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-tert-butylphenyl)methyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-tert-butylphenyl)methyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-tert-butylphenyl)methyl]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(4-tert-butylphenyl)methyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-tert-butylbenzyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H22N2OS MolecularWeight: 374.49858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2OS/c1-23(2,3)18-11-9-16(10-12-18)14-25-15-24-21-19(22(25)26)13-20(27-21)17-7-5-4-6-8-17/h4-13,15H,14H2,1-3H3