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(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-morpholin-4-yl-3-oxidanylidene-propanethioamide

(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-morpholin-4-yl-3-oxidanylidene-propanethioamide

Systemtic Name:(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-morpholin-4-yl-3-oxidanylidene-propanethioamide
Openeye Name:(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-morpholino-3-oxo-propanethioamide
CAS Name:(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-(4-morpholinyl)-3-oxopropanethioamide
IUPAC Name:(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-morpholin-4-yl-3-oxopropanethioamide
Traditional Name:(2S)-2-cyano-N-(2,4-dimethylphenyl)-3-keto-3-morpholino-thiopropionamide
Formula: C16H19N3O2S
MolecularWeight: 317.40596
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)C(C#N)C(=O)N2CCOCC2)C


Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)[C@@H](C#N)C(=O)N2CCOCC2)C


InChI

InChI=1S/C16H19N3O2S/c1-11-3-4-14(12(2)9-11)18-15(22)13(10-17)16(20)19-5-7-21-8-6-19/h3-4,9,13H,5-8H2,1-2H3,(H,18,22)/t13-/m1/s1


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