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9-[(2R,3S)-1-butoxy-3-phenylmethoxy-butan-2-yl]purin-6-amine

9-[(2R,3S)-1-butoxy-3-phenylmethoxy-butan-2-yl]purin-6-amine

Systemtic Name:9-[(2R,3S)-1-butoxy-3-phenylmethoxy-butan-2-yl]purin-6-amine
Openeye Name:9-[(1R,2S)-2-benzyloxy-1-(butoxymethyl)propyl]purin-6-amine
CAS Name:9-[(2R,3S)-1-butoxy-3-phenylmethoxybutan-2-yl]-6-purinamine
IUPAC Name:9-[(2R,3S)-1-butoxy-3-phenylmethoxybutan-2-yl]purin-6-amine
Traditional Name:[9-[(1R,2S)-2-benzoxy-1-(butoxymethyl)propyl]purin-6-yl]amine
Formula: C20H27N5O2
MolecularWeight: 369.46068
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C(C)OCC1=CC=CC=C1)N2C=NC3=C2N=CN=C3N


Isomeric SMILES

CCCCOC[C@H]([C@H](C)OCC1=CC=CC=C1)N2C=NC3=C2N=CN=C3N


InChI

InChI=1S/C20H27N5O2/c1-3-4-10-26-12-17(15(2)27-11-16-8-6-5-7-9-16)25-14-24-18-19(21)22-13-23-20(18)25/h5-9,13-15,17H,3-4,10-12H2,1-2H3,(H2,21,22,23)/t15-,17+/m0/s1


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