N-[4-(dimethylsulfamoyl)phenyl]-3-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[4-(dimethylsulfamoyl)phenyl]-3-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-[4-(dimethylsulfamoyl)phenyl]-3-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-[4-(dimethylsulfamoyl)phenyl]-3-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-[4-(dimethylsulfamoyl)phenyl]-3-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-[4-(dimethylsulfamoyl)phenyl]-3-[(4-methyl-2-quinolyl)thio]propionamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H23N3O3S2/c1-15-14-21(23-19-7-5-4-6-18(15)19)28-13-12-20(25)22-16-8-10-17(11-9-16)29(26,27)24(2)3/h4-11,14H,12-13H2,1-3H3,(H,22,25)