(5-bromanylthiophen-2-yl)methyl-ethyl-[2-oxidanylidene-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-ethyl-[2-oxidanylidene-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-ethyl-[2-oxo-2-(5-sulfamoylindolin-1-yl)ethyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-ethyl-[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-ethyl-[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-ethyl-[2-keto-2-(5-sulfamoylindolin-1-yl)ethyl]ammonium Formula: C17H21BrN3O3S2+ MolecularWeight: 459.40094

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(S1)Br)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N

Isomeric SMILES

CC[NH+](CC1=CC=C(S1)Br)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C17H20BrN3O3S2/c1-2-20(10-13-3-6-16(18)25-13)11-17(22)21-8-7-12-9-14(26(19,23)24)4-5-15(12)21/h3-6,9H,2,7-8,10-11H2,1H3,(H2,19,23,24)/p+1