N-(3-bromophenyl)-6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-(3-bromophenyl)-6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-[6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C12H10BrN5S MolecularWeight: 336.2103

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2)C(=N1)NC3=CC(=CC=C3)Br

Isomeric SMILES

CSC1=NC2=C(C=NN2)C(=N1)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C12H10BrN5S/c1-19-12-16-10(9-6-14-18-11(9)17-12)15-8-4-2-3-7(13)5-8/h2-6H,1H3,(H2,14,15,16,17,18)