2,2-dimethyl-N-[4-(2-quinolin-4-ylsulfanylethanoyl)phenyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[4-(2-quinolin-4-ylsulfanylethanoyl)phenyl]propanamide Openeye Name: 2,2-dimethyl-N-[4-[2-(4-quinolylsulfanyl)acetyl]phenyl]propanamide CAS Name: 2,2-dimethyl-N-[4-[1-oxo-2-(4-quinolinylthio)ethyl]phenyl]propanamide IUPAC Name: 2,2-dimethyl-N-[4-(2-quinolin-4-ylsulfanylacetyl)phenyl]propanamide Traditional Name: 2,2-dimethyl-N-[4-[2-(4-quinolylthio)acetyl]phenyl]propionamide Formula: C22H22N2O2S MolecularWeight: 378.48728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)CSC2=CC=NC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)CSC2=CC=NC3=CC=CC=C32

InChI

InChI=1S/C22H22N2O2S/c1-22(2,3)21(26)24-16-10-8-15(9-11-16)19(25)14-27-20-12-13-23-18-7-5-4-6-17(18)20/h4-13H,14H2,1-3H3,(H,24,26)