N-[4-[(phenylmethyl)sulfamoyl]phenyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-[4-[(phenylmethyl)sulfamoyl]phenyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-[4-[(phenylmethyl)sulfamoyl]phenyl]-2-[(4,6,8-trimethyl-2-quinolinyl)thio]butanamide IUPAC Name: N-[4-(benzylsulfamoyl)phenyl]-2-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(4,6,8-trimethyl-2-quinolyl)thio]butyramide Formula: C29H31N3O3S2 MolecularWeight: 533.70474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC4=C(C=C(C=C4C(=C3)C)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC4=C(C=C(C=C4C(=C3)C)C)C

InChI

InChI=1S/C29H31N3O3S2/c1-5-26(36-27-17-20(3)25-16-19(2)15-21(4)28(25)32-27)29(33)31-23-11-13-24(14-12-23)37(34,35)30-18-22-9-7-6-8-10-22/h6-17,26,30H,5,18H2,1-4H3,(H,31,33)