5-(4-bromophenyl)-6-(2-dimethylaminoethylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-6-(2-dimethylaminoethylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-(2-dimethylaminoethylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-(2-dimethylaminoethylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-(4-bromophenyl)-6-(2-dimethylaminoethylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-(2-dimethylaminoethylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C15H16BrN5OS MolecularWeight: 394.28944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=C(C=NN2)C(=O)N1C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)CCSC1=NC2=C(C=NN2)C(=O)N1C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H16BrN5OS/c1-20(2)7-8-23-15-18-13-12(9-17-19-13)14(22)21(15)11-5-3-10(16)4-6-11/h3-6,9H,7-8H2,1-2H3,(H,17,19)