6-chloranyl-N-[(E)-octylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-[(E)-octylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-chloro-N-[(E)-octylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-chloro-N-[(E)-octylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: 6-chloro-N-[(E)-octylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (6-chloro-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-[(E)-octylideneamino]amine Formula: C13H19ClN6 MolecularWeight: 294.78316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=NNC1=NC(=NC2=C1C=NN2)Cl

Isomeric SMILES

CCCCCCC/C=N/NC1=NC(=NC2=C1C=NN2)Cl

InChI

InChI=1S/C13H19ClN6/c1-2-3-4-5-6-7-8-15-19-11-10-9-16-20-12(10)18-13(14)17-11/h8-9H,2-7H2,1H3,(H2,16,17,18,19,20)/b15-8+