5-(6-aminopurin-9-yl)-4-oxidanyl-3-(1,3-thiazolidin-4-ylcarbonylamino)oxolane-2-carboxylic acid

Systemtic Name: 5-(6-aminopurin-9-yl)-4-oxidanyl-3-(1,3-thiazolidin-4-ylcarbonylamino)oxolane-2-carboxylic acid Openeye Name: 5-(6-aminopurin-9-yl)-4-hydroxy-3-(thiazolidine-4-carbonylamino)tetrahydrofuran-2-carboxylic acid CAS Name: 5-(6-aminopurin-9-yl)-4-hydroxy-3-[[oxo(4-thiazolidinyl)methyl]amino]-2-oxolanecarboxylic acid IUPAC Name: 5-(6-aminopurin-9-yl)-4-hydroxy-3-(1,3-thiazolidine-4-carbonylamino)oxolane-2-carboxylic acid Traditional Name: 5-adenin-9-yl-4-hydroxy-3-(thiazolidine-4-carbonylamino)tetrahydrofuran-2-carboxylic acid Formula: C14H17N7O5S MolecularWeight: 395.39368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCS1)C(=O)NC2C(C(OC2C(=O)O)N3C=NC4=C3N=CN=C4N)O

Isomeric SMILES

C1C(NCS1)C(=O)NC2C(C(OC2C(=O)O)N3C=NC4=C3N=CN=C4N)O

InChI

InChI=1S/C14H17N7O5S/c15-10-7-11(17-2-16-10)21(3-18-7)13-8(22)6(9(26-13)14(24)25)20-12(23)5-1-27-4-19-5/h2-3,5-6,8-9,13,19,22H,1,4H2,(H,20,23)(H,24,25)(H2,15,16,17)