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

Systemtic Name: 5-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-2-(3,4-dimethoxyphenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H19BrN2O3S MolecularWeight: 471.36686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19BrN2O3S/c1-4-17-18(12-5-8-14(23)9-6-12)19-21(26)24-20(25-22(19)29-17)13-7-10-15(27-2)16(11-13)28-3/h5-11H,4H2,1-3H3,(H,24,25,26)