[1-oxidanylidene-1-(7H-purin-6-ylamino)propan-2-yl] 2-(4-oxidanylidene-1,3-thiazolidin-3-yl)ethanoate

Systemtic Name: [1-oxidanylidene-1-(7H-purin-6-ylamino)propan-2-yl] 2-(4-oxidanylidene-1,3-thiazolidin-3-yl)ethanoate Openeye Name: [1-methyl-2-oxo-2-(7H-purin-6-ylamino)ethyl] 2-(4-oxothiazolidin-3-yl)acetate CAS Name: 2-(4-oxo-3-thiazolidinyl)acetic acid [1-oxo-1-(7H-purin-6-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(7H-purin-6-ylamino)propan-2-yl] 2-(4-oxo-1,3-thiazolidin-3-yl)acetate Traditional Name: 2-(4-ketothiazolidin-3-yl)acetic acid [2-keto-1-methyl-2-(7H-purin-6-ylamino)ethyl] ester Formula: C13H14N6O4S MolecularWeight: 350.35306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=NC2=C1NC=N2)OC(=O)CN3CSCC3=O

Isomeric SMILES

CC(C(=O)NC1=NC=NC2=C1NC=N2)OC(=O)CN3CSCC3=O

InChI

InChI=1S/C13H14N6O4S/c1-7(23-9(21)2-19-6-24-3-8(19)20)13(22)18-12-10-11(15-4-14-10)16-5-17-12/h4-5,7H,2-3,6H2,1H3,(H2,14,15,16,17,18,22)