2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C24H27N3O3S2 MolecularWeight: 469.61948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H27N3O3S2/c1-16-7-6-8-21-17(2)15-22(26-23(16)21)31-18(3)24(28)25-19-9-11-20(12-10-19)32(29,30)27-13-4-5-14-27/h6-12,15,18H,4-5,13-14H2,1-3H3,(H,25,28)