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

Systemtic Name: 5-(4-bromophenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-benzyl-5-(4-bromophenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-ethyl-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-benzyl-5-(4-bromophenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-benzyl-5-(4-bromophenyl)-6-ethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H17BrN2OS MolecularWeight: 425.34148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN2OS/c1-2-16-18(14-8-10-15(22)11-9-14)19-20(25)23-17(24-21(19)26-16)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,23,24,25)