[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl 2-oxidanylbenzoate

Systemtic Name: [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl 2-oxidanylbenzoate Openeye Name: [5-(4-amino-2-oxo-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [5-(4-amino-2-oxo-1-pyrimidinyl)-1,3-oxathiolan-2-yl]methyl ester IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [5-(4-amino-2-keto-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl ester Formula: C15H15N3O5S MolecularWeight: 349.3617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(S1)COC(=O)C2=CC=CC=C2O)N3C=CC(=NC3=O)N

Isomeric SMILES

C1C(OC(S1)COC(=O)C2=CC=CC=C2O)N3C=CC(=NC3=O)N

InChI

InChI=1S/C15H15N3O5S/c16-11-5-6-18(15(21)17-11)12-8-24-13(23-12)7-22-14(20)9-3-1-2-4-10(9)19/h1-6,12-13,19H,7-8H2,(H2,16,17,21)