methyl (2R)-4-[(4-fluorophenyl)methylcarbamothioyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(4-fluorophenyl)methylcarbamothioyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(4-fluorophenyl)methylcarbamothioyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(4-fluorophenyl)methylcarbamothioyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(4-fluorobenzyl)thiocarbamoyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C14H17FN2O2S2 MolecularWeight: 328.425383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C14H17FN2O2S2/c1-19-13(18)12-9-17(6-7-21-12)14(20)16-8-10-2-4-11(15)5-3-10/h2-5,12H,6-9H2,1H3,(H,16,20)/t12-/m1/s1