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

Systemtic Name: 5-(4-ethylphenyl)-3-[(3-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-ethylphenyl)-3-(m-tolylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-ethylphenyl)-3-[(3-methylphenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-ethylphenyl)-3-[(3-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-ethylphenyl)-3-(3-methylbenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2OS MolecularWeight: 360.472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=CC(=C4)C

InChI

InChI=1S/C22H20N2OS/c1-3-16-7-9-18(10-8-16)19-13-26-21-20(19)22(25)24(14-23-21)12-17-6-4-5-15(2)11-17/h4-11,13-14H,3,12H2,1-2H3