(2R)-2-cyano-N-(2-methoxyphenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-propanethioamide

Systemtic Name: (2R)-2-cyano-N-(2-methoxyphenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-propanethioamide Openeye Name: (2R)-2-cyano-N-(2-methoxyphenyl)-3-oxo-3-pyrrolidin-1-yl-propanethioamide CAS Name: (2R)-2-cyano-N-(2-methoxyphenyl)-3-oxo-3-(1-pyrrolidinyl)propanethioamide IUPAC Name: (2R)-2-cyano-N-(2-methoxyphenyl)-3-oxo-3-pyrrolidin-1-ylpropanethioamide Traditional Name: (2R)-2-cyano-3-keto-N-(2-methoxyphenyl)-3-pyrrolidino-thiopropionamide Formula: C15H17N3O2S MolecularWeight: 303.37938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)C(C#N)C(=O)N2CCCC2

Isomeric SMILES

COC1=CC=CC=C1NC(=S)[C@H](C#N)C(=O)N2CCCC2

InChI

InChI=1S/C15H17N3O2S/c1-20-13-7-3-2-6-12(13)17-14(21)11(10-16)15(19)18-8-4-5-9-18/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,17,21)/t11-/m0/s1