[5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(phenylcarbonylsulfanylmethyl)oxolan-3-yl] benzoate

Systemtic Name: [5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(phenylcarbonylsulfanylmethyl)oxolan-3-yl] benzoate Openeye Name: [2-(benzoylsulfanylmethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl] benzoate CAS Name: benzoic acid [2-[(benzoylthio)methyl]-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl] ester IUPAC Name: [2-(benzoylsulfanylmethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] benzoate Traditional Name: benzoic acid [2-[(benzoylthio)methyl]-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-3-yl] ester Formula: C24H22N2O6S MolecularWeight: 466.50628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CSC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CSC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O6S/c1-15-13-26(24(30)25-21(15)27)20-12-18(32-22(28)16-8-4-2-5-9-16)19(31-20)14-33-23(29)17-10-6-3-7-11-17/h2-11,13,18-20H,12,14H2,1H3,(H,25,27,30)