N-(2,6-diethylphenyl)-3-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2,6-diethylphenyl)-3-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-(2,6-diethylphenyl)-3-(2-quinolylsulfanyl)propanamide CAS Name: N-(2,6-diethylphenyl)-3-(2-quinolinylthio)propanamide IUPAC Name: N-(2,6-diethylphenyl)-3-quinolin-2-ylsulfanylpropanamide Traditional Name: N-(2,6-diethylphenyl)-3-(2-quinolylthio)propionamide Formula: C22H24N2OS MolecularWeight: 364.50376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CCSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CCSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H24N2OS/c1-3-16-9-7-10-17(4-2)22(16)24-20(25)14-15-26-21-13-12-18-8-5-6-11-19(18)23-21/h5-13H,3-4,14-15H2,1-2H3,(H,24,25)