5-(4-bromophenyl)-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-3-(3-phenylpropyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H17BrN2OS MolecularWeight: 425.34148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2OS/c22-17-10-8-16(9-11-17)18-13-26-20-19(18)21(25)24(14-23-20)12-4-7-15-5-2-1-3-6-15/h1-3,5-6,8-11,13-14H,4,7,12H2