ethyl (5S,6R)-2-methylsulfanyl-5-phenyl-5,6-dihydro-4H-1,3,4-thiadiazine-6-carboxylate

Systemtic Name: ethyl (5S,6R)-2-methylsulfanyl-5-phenyl-5,6-dihydro-4H-1,3,4-thiadiazine-6-carboxylate Openeye Name: ethyl (5S,6R)-2-methylsulfanyl-5-phenyl-5,6-dihydro-4H-1,3,4-thiadiazine-6-carboxylate CAS Name: (5S,6R)-2-(methylthio)-5-phenyl-5,6-dihydro-4H-1,3,4-thiadiazine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (5S,6R)-2-methylsulfanyl-5-phenyl-5,6-dihydro-4H-1,3,4-thiadiazine-6-carboxylate Traditional Name: (5S,6R)-2-(methylthio)-5-phenyl-5,6-dihydro-4H-1,3,4-thiadiazine-6-carboxylic acid ethyl ester Formula: C13H16N2O2S2 MolecularWeight: 296.40834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NN=C(S1)SC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](NN=C(S1)SC)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2O2S2/c1-3-17-12(16)11-10(9-7-5-4-6-8-9)14-15-13(18-2)19-11/h4-8,10-11,14H,3H2,1-2H3/t10-,11+/m0/s1