(2S,3S)-3-[6-(butylamino)-2-phenyl-purin-9-yl]nonan-2-ol

Systemtic Name: (2S,3S)-3-[6-(butylamino)-2-phenyl-purin-9-yl]nonan-2-ol Openeye Name: (2S,3S)-3-[6-(butylamino)-2-phenyl-purin-9-yl]nonan-2-ol CAS Name: (2S,3S)-3-[6-(butylamino)-2-phenyl-9-purinyl]-2-nonanol IUPAC Name: (2S,3S)-3-[6-(butylamino)-2-phenylpurin-9-yl]nonan-2-ol Traditional Name: (2S,3S)-3-[6-(butylamino)-2-phenyl-purin-9-yl]nonan-2-ol Formula: C24H35N5O MolecularWeight: 409.5676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)O)N1C=NC2=C1N=C(N=C2NCCCC)C3=CC=CC=C3

Isomeric SMILES

CCCCCC[C@@H]([C@H](C)O)N1C=NC2=C1N=C(N=C2NCCCC)C3=CC=CC=C3

InChI

InChI=1S/C24H35N5O/c1-4-6-8-12-15-20(18(3)30)29-17-26-21-23(25-16-7-5-2)27-22(28-24(21)29)19-13-10-9-11-14-19/h9-11,13-14,17-18,20,30H,4-8,12,15-16H2,1-3H3,(H,25,27,28)/t18-,20-/m0/s1