(2R)-2-azanyl-3-[2-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)ethylsulfanyl]propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[2-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)ethylsulfanyl]propanoic acid Openeye Name: (2R)-2-amino-3-[2-(2-amino-6-oxo-3H-purin-7-yl)ethylsulfanyl]propanoic acid CAS Name: (2R)-2-amino-3-[2-(2-amino-6-oxo-3H-purin-7-yl)ethylthio]propanoic acid IUPAC Name: (2R)-2-amino-3-[2-(2-amino-6-oxo-3H-purin-7-yl)ethylsulfanyl]propanoic acid Traditional Name: (2R)-2-amino-3-[2-(2-amino-6-keto-3H-purin-7-yl)ethylthio]propionic acid Formula: C10H14N6O3S MolecularWeight: 298.32156

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCSCC(C(=O)O)N)C(=O)N=C(N2)N

Isomeric SMILES

C1=NC2=C(N1CCSC[C@@H](C(=O)O)N)C(=O)N=C(N2)N

InChI

InChI=1S/C10H14N6O3S/c11-5(9(18)19)3-20-2-1-16-4-13-7-6(16)8(17)15-10(12)14-7/h4-5H,1-3,11H2,(H,18,19)(H3,12,14,15,17)/t5-/m0/s1