6-[2-azanyl-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]purin-6-yl]sulfanylhexan-1-ol

Systemtic Name: 6-[2-azanyl-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]purin-6-yl]sulfanylhexan-1-ol Openeye Name: 6-[2-amino-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]purin-6-yl]sulfanylhexan-1-ol CAS Name: 6-[[2-amino-9-[4-(hydroxymethyl)-1-cyclopent-2-enyl]-6-purinyl]thio]-1-hexanol IUPAC Name: 6-[2-amino-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]purin-6-yl]sulfanylhexan-1-ol Traditional Name: 6-[[2-amino-9-(4-methylolcyclopent-2-en-1-yl)purin-6-yl]thio]hexan-1-ol Formula: C17H25N5O2S MolecularWeight: 363.4777

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1N2C=NC3=C2N=C(N=C3SCCCCCCO)N)CO

Isomeric SMILES

C1C(C=CC1N2C=NC3=C2N=C(N=C3SCCCCCCO)N)CO

InChI

InChI=1S/C17H25N5O2S/c18-17-20-15-14(16(21-17)25-8-4-2-1-3-7-23)19-11-22(15)13-6-5-12(9-13)10-24/h5-6,11-13,23-24H,1-4,7-10H2,(H2,18,20,21)