2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide

Systemtic Name: 2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide Openeye Name: 2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide CAS Name: 2-[(8-methoxy-4-methyl-2-quinolinyl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(8-methoxy-4-methylquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide Traditional Name: 2-[(8-methoxy-4-methyl-2-quinolyl)thio]-N-(4-pyrrolidinosulfonylphenyl)butyramide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SC3=NC4=C(C=CC=C4OC)C(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SC3=NC4=C(C=CC=C4OC)C(=C3)C

InChI

InChI=1S/C25H29N3O4S2/c1-4-22(33-23-16-17(2)20-8-7-9-21(32-3)24(20)27-23)25(29)26-18-10-12-19(13-11-18)34(30,31)28-14-5-6-15-28/h7-13,16,22H,4-6,14-15H2,1-3H3,(H,26,29)