4-methylsulfanyl-2-(5H-purin-6-ylamino)butanoic acid

Systemtic Name: 4-methylsulfanyl-2-(5H-purin-6-ylamino)butanoic acid Openeye Name: 4-methylsulfanyl-2-(5H-purin-6-ylamino)butanoic acid CAS Name: 4-(methylthio)-2-(5H-purin-6-ylamino)butanoic acid IUPAC Name: 4-methylsulfanyl-2-(5H-purin-6-ylamino)butanoic acid Traditional Name: 4-(methylthio)-2-(5H-purin-6-ylamino)butyric acid Formula: C10H13N5O2S MolecularWeight: 267.30752

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC1=NC=NC2=NC=NC21

Isomeric SMILES

CSCCC(C(=O)O)NC1=NC=NC2=NC=NC21

InChI

InChI=1S/C10H13N5O2S/c1-18-3-2-6(10(16)17)15-9-7-8(12-4-11-7)13-5-14-9/h4-7H,2-3H2,1H3,(H,16,17)(H,11,12,13,14,15)