(2R)-2-azanyl-5-oxidanylidene-5-(7H-purin-6-ylsulfanylmethoxy)pentanoic acid

Systemtic Name: (2R)-2-azanyl-5-oxidanylidene-5-(7H-purin-6-ylsulfanylmethoxy)pentanoic acid Openeye Name: (2R)-2-amino-5-oxo-5-(7H-purin-6-ylsulfanylmethoxy)pentanoic acid CAS Name: (2R)-2-amino-5-oxo-5-[(7H-purin-6-ylthio)methoxy]pentanoic acid IUPAC Name: (2R)-2-amino-5-oxo-5-(7H-purin-6-ylsulfanylmethoxy)pentanoic acid Traditional Name: (2R)-2-amino-5-keto-5-[(7H-purin-6-ylthio)methoxy]valeric acid Formula: C11H13N5O4S MolecularWeight: 311.31702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O4S/c12-6(11(18)19)1-2-7(17)20-5-21-10-8-9(14-3-13-8)15-4-16-10/h3-4,6H,1-2,5,12H2,(H,18,19)(H,13,14,15,16)/t6-/m1/s1