2-[(3,4-dimethoxyphenyl)methyl]-6-ethyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]-6-ethyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3,4-dimethoxyphenyl)methyl]-6-ethyl-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3,4-dimethoxyphenyl)methyl]-6-ethyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3,4-dimethoxyphenyl)methyl]-6-ethyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-5-(2-thienyl)-2-veratryl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H20N2O3S2 MolecularWeight: 412.5251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=C(NC2=O)CC3=CC(=C(C=C3)OC)OC)C4=CC=CS4

Isomeric SMILES

CCC1=C(C2=C(S1)N=C(NC2=O)CC3=CC(=C(C=C3)OC)OC)C4=CC=CS4

InChI

InChI=1S/C21H20N2O3S2/c1-4-15-18(16-6-5-9-27-16)19-20(24)22-17(23-21(19)28-15)11-12-7-8-13(25-2)14(10-12)26-3/h5-10H,4,11H2,1-3H3,(H,22,23,24)