5-ethyl-1-[4-oxidanyl-5-[(phenylmethyl)sulfonylmethyl]oxolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 5-ethyl-1-[4-oxidanyl-5-[(phenylmethyl)sulfonylmethyl]oxolan-2-yl]pyrimidine-2,4-dione Openeye Name: 1-[5-(benzylsulfonylmethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-ethyl-pyrimidine-2,4-dione CAS Name: 5-ethyl-1-[4-hydroxy-5-[(phenylmethyl)sulfonylmethyl]-2-oxolanyl]pyrimidine-2,4-dione IUPAC Name: 1-[5-(benzylsulfonylmethyl)-4-hydroxyoxolan-2-yl]-5-ethylpyrimidine-2,4-dione Traditional Name: 1-[5-(benzylsulfonylmethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-ethyl-pyrimidine-2,4-quinone Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)NC1=O)C2CC(C(O2)CS(=O)(=O)CC3=CC=CC=C3)O

Isomeric SMILES

CCC1=CN(C(=O)NC1=O)C2CC(C(O2)CS(=O)(=O)CC3=CC=CC=C3)O

InChI

InChI=1S/C18H22N2O6S/c1-2-13-9-20(18(23)19-17(13)22)16-8-14(21)15(26-16)11-27(24,25)10-12-6-4-3-5-7-12/h3-7,9,14-16,21H,2,8,10-11H2,1H3,(H,19,22,23)