1-[3-(dimethylsulfamoyl)-5-(quinolin-6-ylmethylamino)phenyl]carbonylpiperidine-3-carboxamide

Systemtic Name: 1-[3-(dimethylsulfamoyl)-5-(quinolin-6-ylmethylamino)phenyl]carbonylpiperidine-3-carboxamide Openeye Name: 1-[3-(dimethylsulfamoyl)-5-(6-quinolylmethylamino)benzoyl]piperidine-3-carboxamide CAS Name: 1-[[3-(dimethylsulfamoyl)-5-(6-quinolinylmethylamino)phenyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: 1-[3-(dimethylsulfamoyl)-5-(quinolin-6-ylmethylamino)benzoyl]piperidine-3-carboxamide Traditional Name: 1-[3-(dimethylsulfamoyl)-5-(6-quinolylmethylamino)benzoyl]nipecotamide Formula: C25H29N5O4S MolecularWeight: 495.59386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=CC(=C1)NCC2=CC3=C(C=C2)N=CC=C3)C(=O)N4CCCC(C4)C(=O)N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=CC(=C1)NCC2=CC3=C(C=C2)N=CC=C3)C(=O)N4CCCC(C4)C(=O)N

InChI

InChI=1S/C25H29N5O4S/c1-29(2)35(33,34)22-13-20(25(32)30-10-4-6-19(16-30)24(26)31)12-21(14-22)28-15-17-7-8-23-18(11-17)5-3-9-27-23/h3,5,7-9,11-14,19,28H,4,6,10,15-16H2,1-2H3,(H2,26,31)