4-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3-fluoranyl-benzenecarbothioamide

Systemtic Name: 4-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3-fluoranyl-benzenecarbothioamide Openeye Name: 4-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3-fluoro-benzenecarbothioamide CAS Name: 4-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]methyl]-3-fluorobenzenecarbothioamide IUPAC Name: 4-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3-fluorobenzenecarbothioamide Traditional Name: 4-[[(2S,6S)-2,6-dimethylmorpholino]methyl]-3-fluoro-thiobenzamide Formula: C14H19FN2OS MolecularWeight: 282.376863

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CC2=C(C=C(C=C2)C(=S)N)F

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)CC2=C(C=C(C=C2)C(=S)N)F

InChI

InChI=1S/C14H19FN2OS/c1-9-6-17(7-10(2)18-9)8-12-4-3-11(14(16)19)5-13(12)15/h3-5,9-10H,6-8H2,1-2H3,(H2,16,19)/t9-,10-/m0/s1