(3R)-1-(2-quinolin-2-ylsulfanylethanoyl)piperidine-3-carboxamide

Systemtic Name: (3R)-1-(2-quinolin-2-ylsulfanylethanoyl)piperidine-3-carboxamide Openeye Name: (3R)-1-[2-(2-quinolylsulfanyl)acetyl]piperidine-3-carboxamide CAS Name: (3R)-1-[1-oxo-2-(2-quinolinylthio)ethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(2-quinolin-2-ylsulfanylacetyl)piperidine-3-carboxamide Traditional Name: (3R)-1-[2-(2-quinolylthio)acetyl]nipecotamide Formula: C17H19N3O2S MolecularWeight: 329.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NC3=CC=CC=C3C=C2)C(=O)N

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)CSC2=NC3=CC=CC=C3C=C2)C(=O)N

InChI

InChI=1S/C17H19N3O2S/c18-17(22)13-5-3-9-20(10-13)16(21)11-23-15-8-7-12-4-1-2-6-14(12)19-15/h1-2,4,6-8,13H,3,5,9-11H2,(H2,18,22)/t13-/m1/s1