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

Systemtic Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(4-methyl-2-quinolyl)thio]butyramide Formula: C26H31N3O3S2 MolecularWeight: 497.67264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2)SC3=NC4=CC=CC=C4C(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2)SC3=NC4=CC=CC=C4C(=C3)C

InChI

InChI=1S/C26H31N3O3S2/c1-3-24(33-25-17-18(2)22-11-7-8-12-23(22)28-25)26(30)27-19-13-15-21(16-14-19)34(31,32)29-20-9-5-4-6-10-20/h7-8,11-17,20,24,29H,3-6,9-10H2,1-2H3,(H,27,30)