2-(5H-purin-6-ylsulfanyl)pentanoic acid

Systemtic Name: 2-(5H-purin-6-ylsulfanyl)pentanoic acid Openeye Name: 2-(5H-purin-6-ylsulfanyl)pentanoic acid CAS Name: 2-(5H-purin-6-ylthio)pentanoic acid IUPAC Name: 2-(5H-purin-6-ylsulfanyl)pentanoic acid Traditional Name: 2-(5H-purin-6-ylthio)valeric acid Formula: C10H12N4O2S MolecularWeight: 252.29288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)SC1=NC=NC2=NC=NC21

Isomeric SMILES

CCCC(C(=O)O)SC1=NC=NC2=NC=NC21

InChI

InChI=1S/C10H12N4O2S/c1-2-3-6(10(15)16)17-9-7-8(12-4-11-7)13-5-14-9/h4-7H,2-3H2,1H3,(H,15,16)