N-(1,3-benzodioxol-5-ylmethyl)-6-morpholin-4-yl-9-propan-2-yl-purin-2-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-morpholin-4-yl-9-propan-2-yl-purin-2-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-9-isopropyl-6-morpholino-purin-2-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-morpholinyl)-9-propan-2-yl-2-purinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-morpholin-4-yl-9-propan-2-ylpurin-2-amine Traditional Name: (9-isopropyl-6-morpholino-purin-2-yl)-piperonyl-amine Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2N3CCOCC3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2N3CCOCC3)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H24N6O3/c1-13(2)26-11-22-17-18(25-5-7-27-8-6-25)23-20(24-19(17)26)21-10-14-3-4-15-16(9-14)29-12-28-15/h3-4,9,11,13H,5-8,10,12H2,1-2H3,(H,21,23,24)