dimethyl-[1-[[[4-(methylsulfamoylmethyl)phenyl]methylcarbamoylamino]methyl]cycloheptyl]azanium

Systemtic Name: dimethyl-[1-[[[4-(methylsulfamoylmethyl)phenyl]methylcarbamoylamino]methyl]cycloheptyl]azanium Openeye Name: dimethyl-[1-[[[4-(methylsulfamoylmethyl)phenyl]methylcarbamoylamino]methyl]cycloheptyl]ammonium CAS Name: dimethyl-[1-[[[[[4-(methylsulfamoylmethyl)phenyl]methylamino]-oxomethyl]amino]methyl]cycloheptyl]ammonium IUPAC Name: dimethyl-[1-[[[4-(methylsulfamoylmethyl)phenyl]methylcarbamoylamino]methyl]cycloheptyl]azanium Traditional Name: dimethyl-[1-[[[4-(methylsulfamoylmethyl)benzyl]carbamoylamino]methyl]cycloheptyl]ammonium Formula: C20H35N4O3S+ MolecularWeight: 411.5819

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)NCC2(CCCCCC2)[NH+](C)C

Isomeric SMILES

CNS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)NCC2(CCCCCC2)[NH+](C)C

InChI

InChI=1S/C20H34N4O3S/c1-21-28(26,27)15-18-10-8-17(9-11-18)14-22-19(25)23-16-20(24(2)3)12-6-4-5-7-13-20/h8-11,21H,4-7,12-16H2,1-3H3,(H2,22,23,25)/p+1