2-(4-methylquinolin-2-yl)sulfanyl-N-[4-[(phenylmethyl)sulfamoyl]phenyl]propanamide

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-[4-[(phenylmethyl)sulfamoyl]phenyl]propanamide Openeye Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-N-[4-[(phenylmethyl)sulfamoyl]phenyl]propanamide IUPAC Name: N-[4-(benzylsulfamoyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(4-methyl-2-quinolyl)thio]propionamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3S2/c1-18-16-25(29-24-11-7-6-10-23(18)24)33-19(2)26(30)28-21-12-14-22(15-13-21)34(31,32)27-17-20-8-4-3-5-9-20/h3-16,19,27H,17H2,1-2H3,(H,28,30)