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

Systemtic Name: 5-(4-bromophenyl)-6-ethyl-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-5-(4-bromophenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-ethyl-3-(phenylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-benzyl-5-(4-bromophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-5-(4-bromophenyl)-6-ethyl-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=CN(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

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

InChI

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