1-[[6-(3-methylbut-3-enylamino)-9-propan-2-yl-purin-2-yl]amino]propan-2-ol

Systemtic Name: 1-[[6-(3-methylbut-3-enylamino)-9-propan-2-yl-purin-2-yl]amino]propan-2-ol Openeye Name: 1-[[9-isopropyl-6-(3-methylbut-3-enylamino)purin-2-yl]amino]propan-2-ol CAS Name: 1-[[6-(3-methylbut-3-enylamino)-9-propan-2-yl-2-purinyl]amino]-2-propanol IUPAC Name: 1-[[6-(3-methylbut-3-enylamino)-9-propan-2-ylpurin-2-yl]amino]propan-2-ol Traditional Name: 1-[[9-isopropyl-6-(3-methylbut-3-enylamino)purin-2-yl]amino]propan-2-ol Formula: C16H26N6O MolecularWeight: 318.41724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCCC(=C)C)NCC(C)O

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCCC(=C)C)NCC(C)O

InChI

InChI=1S/C16H26N6O/c1-10(2)6-7-17-14-13-15(22(9-19-13)11(3)4)21-16(20-14)18-8-12(5)23/h9,11-12,23H,1,6-8H2,2-5H3,(H2,17,18,20,21)