methyl (2R)-4-(4-cyanophenyl)carbonylthiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-(4-cyanophenyl)carbonylthiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-(4-cyanobenzoyl)thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(4-cyanophenyl)-oxomethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-(4-cyanobenzoyl)thiomorpholine-2-carboxylate Traditional Name: (2R)-4-(4-cyanobenzoyl)thiomorpholine-2-carboxylic acid methyl ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O3S/c1-19-14(18)12-9-16(6-7-20-12)13(17)11-4-2-10(8-15)3-5-11/h2-5,12H,6-7,9H2,1H3/t12-/m1/s1