3-acetamido-N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide

Systemtic Name: 3-acetamido-N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Openeye Name: 3-acetamido-N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide CAS Name: 3-acetamido-N-[5-(diethylsulfamoyl)-2-(4-methyl-1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-acetamido-N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Traditional Name: 3-acetamido-N-[5-(diethylsulfamoyl)-2-(4-methylpiperazin-4-ium-1-yl)phenyl]propionamide Formula: C20H34N5O4S+ MolecularWeight: 440.58006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)C)NC(=O)CCNC(=O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)C)NC(=O)CCNC(=O)C

InChI

InChI=1S/C20H33N5O4S/c1-5-25(6-2)30(28,29)17-7-8-19(24-13-11-23(4)12-14-24)18(15-17)22-20(27)9-10-21-16(3)26/h7-8,15H,5-6,9-14H2,1-4H3,(H,21,26)(H,22,27)/p+1