2-(4-methylquinolin-2-yl)sulfanyl-N-[4-(phenethylsulfamoyl)phenyl]butanamide

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[4-(phenethylsulfamoyl)phenyl]butanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-[4-(phenethylsulfamoyl)phenyl]butanamide CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-N-[4-(phenethylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[4-(phenethylsulfamoyl)phenyl]butanamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-[4-(phenethylsulfamoyl)phenyl]butyramide Formula: C28H29N3O3S2 MolecularWeight: 519.67816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=C3)C

InChI

InChI=1S/C28H29N3O3S2/c1-3-26(35-27-19-20(2)24-11-7-8-12-25(24)31-27)28(32)30-22-13-15-23(16-14-22)36(33,34)29-18-17-21-9-5-4-6-10-21/h4-16,19,26,29H,3,17-18H2,1-2H3,(H,30,32)