3-[(2-oxidanylidene-2-piperidin-1-yl-ethyl)-phenyl-amino]propanethioamide

Systemtic Name: 3-[(2-oxidanylidene-2-piperidin-1-yl-ethyl)-phenyl-amino]propanethioamide Openeye Name: 3-(N-[2-oxo-2-(1-piperidyl)ethyl]anilino)propanethioamide CAS Name: 3-(N-[2-oxo-2-(1-piperidinyl)ethyl]anilino)propanethioamide IUPAC Name: 3-(N-(2-oxo-2-piperidin-1-ylethyl)anilino)propanethioamide Traditional Name: 3-(N-(2-keto-2-piperidino-ethyl)anilino)thiopropionamide Formula: C16H23N3OS MolecularWeight: 305.43832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN(CCC(=S)N)C2=CC=CC=C2

Isomeric SMILES

C1CCN(CC1)C(=O)CN(CCC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C16H23N3OS/c17-15(21)9-12-19(14-7-3-1-4-8-14)13-16(20)18-10-5-2-6-11-18/h1,3-4,7-8H,2,5-6,9-13H2,(H2,17,21)