(2S)-N-(2-carbamothioylphenyl)-2-(2-oxidanylidenepyrrolidin-1-yl)propanamide

Systemtic Name: (2S)-N-(2-carbamothioylphenyl)-2-(2-oxidanylidenepyrrolidin-1-yl)propanamide Openeye Name: (2S)-N-(2-carbamothioylphenyl)-2-(2-oxopyrrolidin-1-yl)propanamide CAS Name: (2S)-N-(2-carbamothioylphenyl)-2-(2-oxo-1-pyrrolidinyl)propanamide IUPAC Name: (2S)-N-(2-carbamothioylphenyl)-2-(2-oxopyrrolidin-1-yl)propanamide Traditional Name: (2S)-2-(2-ketopyrrolidino)-N-(2-thiocarbamoylphenyl)propionamide Formula: C14H17N3O2S MolecularWeight: 291.36868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=S)N)N2CCCC2=O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C(=S)N)N2CCCC2=O

InChI

InChI=1S/C14H17N3O2S/c1-9(17-8-4-7-12(17)18)14(19)16-11-6-3-2-5-10(11)13(15)20/h2-3,5-6,9H,4,7-8H2,1H3,(H2,15,20)(H,16,19)/t9-/m0/s1