[3,4-diacetyloxy-5-(6-azanyl-8-sulfanylidene-7H-purin-9-yl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-(6-azanyl-8-sulfanylidene-7H-purin-9-yl)oxolan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-5-(6-amino-8-thioxo-7H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3,4-diacetyloxy-5-(6-amino-8-sulfanylidene-7H-purin-9-yl)-2-oxolanyl]methyl ester IUPAC Name: [3,4-diacetyloxy-5-(6-amino-8-sulfanylidene-7H-purin-9-yl)oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3,4-diacetoxy-5-(6-amino-8-thioxo-7H-purin-9-yl)tetrahydrofuran-2-yl]methyl ester Formula: C16H19N5O7S MolecularWeight: 425.41636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C3=C(C(=NC=N3)N)NC2=S)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C3=C(C(=NC=N3)N)NC2=S)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H19N5O7S/c1-6(22)25-4-9-11(26-7(2)23)12(27-8(3)24)15(28-9)21-14-10(20-16(21)29)13(17)18-5-19-14/h5,9,11-12,15H,4H2,1-3H3,(H,20,29)(H2,17,18,19)