N-[4-(cyclohexylsulfamoyl)phenyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(4,8-dimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-(4,8-dimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(4,8-dimethyl-2-quinolyl)thio]propionamide Formula: C26H31N3O3S2 MolecularWeight: 497.67264

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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)NC4CCCCC4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4CCCCC4

InChI

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