(phenylmethyl) 2-(1-methylimidazol-2-yl)sulfanyl-5-oxidanylidene-oxolane-2-carboxylate

Systemtic Name: (phenylmethyl) 2-(1-methylimidazol-2-yl)sulfanyl-5-oxidanylidene-oxolane-2-carboxylate Openeye Name: benzyl 2-(1-methylimidazol-2-yl)sulfanyl-5-oxo-tetrahydrofuran-2-carboxylate CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-5-oxo-2-oxolanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(1-methylimidazol-2-yl)sulfanyl-5-oxooxolane-2-carboxylate Traditional Name: 5-keto-2-[(1-methylimidazol-2-yl)thio]tetrahydrofuran-2-carboxylic acid benzyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2(CCC(=O)O2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1SC2(CCC(=O)O2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H16N2O4S/c1-18-10-9-17-15(18)23-16(8-7-13(19)22-16)14(20)21-11-12-5-3-2-4-6-12/h2-6,9-10H,7-8,11H2,1H3