6-azanyl-2-[(2S)-pentan-2-yl]oxy-9-(5-piperidin-1-ylpentyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-[(2S)-pentan-2-yl]oxy-9-(5-piperidin-1-ylpentyl)-7H-purin-8-one Openeye Name: 6-amino-2-[(1S)-1-methylbutoxy]-9-[5-(1-piperidyl)pentyl]-7H-purin-8-one CAS Name: 6-amino-2-[(2S)-pentan-2-yl]oxy-9-[5-(1-piperidinyl)pentyl]-7H-purin-8-one IUPAC Name: 6-amino-2-[(2S)-pentan-2-yl]oxy-9-(5-piperidin-1-ylpentyl)-7H-purin-8-one Traditional Name: 6-amino-2-[(1S)-1-methylbutoxy]-9-(5-piperidinopentyl)-7H-purin-8-one Formula: C20H34N6O2 MolecularWeight: 390.52296

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC1=NC2=C(C(=N1)N)NC(=O)N2CCCCCN3CCCCC3

Isomeric SMILES

CCC[C@H](C)OC1=NC2=C(C(=N1)N)NC(=O)N2CCCCCN3CCCCC3

InChI

InChI=1S/C20H34N6O2/c1-3-10-15(2)28-19-23-17(21)16-18(24-19)26(20(27)22-16)14-9-5-8-13-25-11-6-4-7-12-25/h15H,3-14H2,1-2H3,(H,22,27)(H2,21,23,24)/t15-/m0/s1