N-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-7-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-7-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-7-amine CAS Name: N-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-1-methyl-3-propyl-7-pyrazolo[4,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-1-methyl-3-propylpyrazolo[4,3-d]pyrimidin-7-amine Traditional Name: 1,3-benzodioxol-5-yl-[5-(4-fluorophenyl)-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-7-yl]amine Formula: C22H20FN5O2 MolecularWeight: 405.424903

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1N=C(N=C2NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F)C

Isomeric SMILES

CCCC1=NN(C2=C1N=C(N=C2NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F)C

InChI

InChI=1S/C22H20FN5O2/c1-3-4-16-19-20(28(2)27-16)22(24-15-9-10-17-18(11-15)30-12-29-17)26-21(25-19)13-5-7-14(23)8-6-13/h5-11H,3-4,12H2,1-2H3,(H,24,25,26)