N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]quinoline-2-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]quinoline-2-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]quinoline-2-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(4-ethyl-1-piperazinyl)phenyl]-2-quinolinecarboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]quinoline-2-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazino)phenyl]quinaldamide Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H33N5O3S/c1-4-29-15-17-30(18-16-29)25-14-12-21(35(33,34)31(5-2)6-3)19-24(25)28-26(32)23-13-11-20-9-7-8-10-22(20)27-23/h7-14,19H,4-6,15-18H2,1-3H3,(H,28,32)