(2S)-2-azanyl-4-[(2-azanyl-7H-purin-6-yl)sulfanylmethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-2-azanyl-4-[(2-azanyl-7H-purin-6-yl)sulfanylmethoxy]-4-oxidanylidene-butanoic acid Openeye Name: (2S)-2-amino-4-[(2-amino-7H-purin-6-yl)sulfanylmethoxy]-4-oxo-butanoic acid CAS Name: (2S)-2-amino-4-[[(2-amino-7H-purin-6-yl)thio]methoxy]-4-oxobutanoic acid IUPAC Name: (2S)-2-amino-4-[(2-amino-7H-purin-6-yl)sulfanylmethoxy]-4-oxobutanoic acid Traditional Name: (2S)-2-amino-4-[[(2-amino-7H-purin-6-yl)thio]methoxy]-4-keto-butyric acid Formula: C10H12N6O4S MolecularWeight: 312.30508

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)N)SCOC(=O)CC(C(=O)O)N

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)N)SCOC(=O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C10H12N6O4S/c11-4(9(18)19)1-5(17)20-3-21-8-6-7(14-2-13-6)15-10(12)16-8/h2,4H,1,3,11H2,(H,18,19)(H3,12,13,14,15,16)/t4-/m0/s1