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

Systemtic Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoxaline-2-carboxamide Formula: C25H33N6O3S+ MolecularWeight: 497.63292

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C25H32N6O3S/c1-4-29-13-15-30(16-14-29)24-12-11-19(35(33,34)31(5-2)6-3)17-22(24)28-25(32)23-18-26-20-9-7-8-10-21(20)27-23/h7-12,17-18H,4-6,13-16H2,1-3H3,(H,28,32)/p+1