5-[(2-azanyl-7H-purin-6-yl)sulfanyl]pentanoic acid

Systemtic Name: 5-[(2-azanyl-7H-purin-6-yl)sulfanyl]pentanoic acid Openeye Name: 5-[(2-amino-7H-purin-6-yl)sulfanyl]pentanoic acid CAS Name: 5-[(2-amino-7H-purin-6-yl)thio]pentanoic acid IUPAC Name: 5-[(2-amino-7H-purin-6-yl)sulfanyl]pentanoic acid Traditional Name: 5-[(2-amino-7H-purin-6-yl)thio]valeric acid Formula: C10H13N5O2S MolecularWeight: 267.30752

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)N)SCCCCC(=O)O

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)N)SCCCCC(=O)O

InChI

InChI=1S/C10H13N5O2S/c11-10-14-8-7(12-5-13-8)9(15-10)18-4-2-1-3-6(16)17/h5H,1-4H2,(H,16,17)(H3,11,12,13,14,15)