1-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-methyl-N-[(2R)-3-methyl-2-(4-methyl-1-piperazin-1-iumyl)butyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C16H28N7+ MolecularWeight: 318.44042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC1=NC=NC2=C1C=NN2C)[NH+]3CCN(CC3)C

Isomeric SMILES

CC(C)[C@H](CNC1=NC=NC2=C1C=NN2C)[NH+]3CCN(CC3)C

InChI

InChI=1S/C16H27N7/c1-12(2)14(23-7-5-21(3)6-8-23)10-17-15-13-9-20-22(4)16(13)19-11-18-15/h9,11-12,14H,5-8,10H2,1-4H3,(H,17,18,19)/p+1/t14-/m0/s1