2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-[(2-methoxyphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[3-[(2-methoxyphenyl)sulfamoyl]phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C18H25N4O3S2+ MolecularWeight: 409.5461

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2OC

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2OC

InChI

InChI=1S/C18H24N4O3S2/c1-22(2)12-11-19-18(26)20-14-7-6-8-15(13-14)27(23,24)21-16-9-4-5-10-17(16)25-3/h4-10,13,21H,11-12H2,1-3H3,(H2,19,20,26)/p+1