N-(2,5-dimethylphenyl)-2-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(2-quinolylsulfanyl)propanamide CAS Name: N-(2,5-dimethylphenyl)-2-(2-quinolinylthio)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-quinolin-2-ylsulfanylpropanamide Traditional Name: N-(2,5-dimethylphenyl)-2-(2-quinolylthio)propionamide Formula: C20H20N2OS MolecularWeight: 336.4506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H20N2OS/c1-13-8-9-14(2)18(12-13)22-20(23)15(3)24-19-11-10-16-6-4-5-7-17(16)21-19/h4-12,15H,1-3H3,(H,22,23)