N-(1,3-benzodioxol-5-ylmethyl)-9-propan-2-yl-2-pyrrolidin-1-yl-purin-6-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-9-propan-2-yl-2-pyrrolidin-1-yl-purin-6-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-9-isopropyl-2-pyrrolidin-1-yl-purin-6-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-9-propan-2-yl-2-(1-pyrrolidinyl)-6-purinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-9-propan-2-yl-2-pyrrolidin-1-ylpurin-6-amine Traditional Name: (9-isopropyl-2-pyrrolidino-purin-6-yl)-piperonyl-amine Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC4=C(C=C3)OCO4)N5CCCC5

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC4=C(C=C3)OCO4)N5CCCC5

InChI

InChI=1S/C20H24N6O2/c1-13(2)26-11-22-17-18(23-20(24-19(17)26)25-7-3-4-8-25)21-10-14-5-6-15-16(9-14)28-12-27-15/h5-6,9,11,13H,3-4,7-8,10,12H2,1-2H3,(H,21,23,24)