N-(1,3-benzodioxol-5-yl)-6-chloranyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-6-chloranyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-6-chloro-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-6-chloro-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-6-chloro-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-(6-chloro-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H12ClN5O2 MolecularWeight: 365.77318

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=C3C=NN4C5=CC=CC=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=C3C=NN4C5=CC=CC=C5)Cl

InChI

InChI=1S/C18H12ClN5O2/c19-18-22-16(21-11-6-7-14-15(8-11)26-10-25-14)13-9-20-24(17(13)23-18)12-4-2-1-3-5-12/h1-9H,10H2,(H,21,22,23)