[5-(5-chloranylpyrimidin-2-yl)sulfanyl-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate

Systemtic Name: [5-(5-chloranylpyrimidin-2-yl)sulfanyl-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate Openeye Name: [3,4-dibenzoyloxy-5-(5-chloropyrimidin-2-yl)sulfanyl-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [3,4-dibenzoyloxy-5-[(5-chloro-2-pyrimidinyl)thio]-2-oxolanyl]methyl ester IUPAC Name: [3,4-dibenzoyloxy-5-(5-chloropyrimidin-2-yl)sulfanyloxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [3,4-dibenzoyloxy-5-[(5-chloropyrimidin-2-yl)thio]tetrahydrofuran-2-yl]methyl ester Formula: C30H23ClN2O7S MolecularWeight: 591.03082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)SC3=NC=C(C=N3)Cl)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)SC3=NC=C(C=N3)Cl)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H23ClN2O7S/c31-22-16-32-30(33-17-22)41-29-25(40-28(36)21-14-8-3-9-15-21)24(39-27(35)20-12-6-2-7-13-20)23(38-29)18-37-26(34)19-10-4-1-5-11-19/h1-17,23-25,29H,18H2