methyl (2R)-4-(3-cyanophenyl)sulfonylthiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-(3-cyanophenyl)sulfonylthiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-(3-cyanophenyl)sulfonylthiomorpholine-2-carboxylate CAS Name: (2R)-4-(3-cyanophenyl)sulfonyl-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-(3-cyanophenyl)sulfonylthiomorpholine-2-carboxylate Traditional Name: (2R)-4-(3-cyanophenyl)sulfonylthiomorpholine-2-carboxylic acid methyl ester Formula: C13H14N2O4S2 MolecularWeight: 326.39126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)S(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)S(=O)(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H14N2O4S2/c1-19-13(16)12-9-15(5-6-20-12)21(17,18)11-4-2-3-10(7-11)8-14/h2-4,7,12H,5-6,9H2,1H3/t12-/m1/s1