O3-ethyl O5-methyl (3S,4R)-4,6-dimethyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-methyl (3S,4R)-4,6-dimethyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl (3S,4R)-4,6-dimethyl-2-thioxo-3,4-dihydro-1H-pyridine-3,5-dicarboxylate CAS Name: (3S,4R)-4,6-dimethyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl (3S,4R)-4,6-dimethyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-3,5-dicarboxylate Traditional Name: (3S,4R)-4,6-dimethyl-2-thioxo-3,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(NC1=S)C)C(=O)OC)C

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](C(=C(NC1=S)C)C(=O)OC)C

InChI

InChI=1S/C12H17NO4S/c1-5-17-12(15)9-6(2)8(11(14)16-4)7(3)13-10(9)18/h6,9H,5H2,1-4H3,(H,13,18)/t6-,9+/m0/s1