N-(3-bromophenyl)-6-methylsulfanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-methylsulfanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-1-isopropyl-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-(methylthio)-1-propan-2-yl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-bromophenyl)-6-methylsulfanyl-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-[1-isopropyl-6-(methylthio)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C15H16BrN5S MolecularWeight: 378.29004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=NC(=N2)SC)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=NC(=N2)SC)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C15H16BrN5S/c1-9(2)21-14-12(8-17-21)13(19-15(20-14)22-3)18-11-6-4-5-10(16)7-11/h4-9H,1-3H3,(H,18,19,20)