2-[[4-[(5-bromanylthiophen-2-yl)sulfonylamino]phenyl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[4-[(5-bromanylthiophen-2-yl)sulfonylamino]phenyl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[4-[(5-bromo-2-thienyl)sulfonylamino]benzoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[4-[(5-bromo-2-thiophenyl)sulfonylamino]phenyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[4-[(5-bromothiophen-2-yl)sulfonylamino]benzoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[4-[(5-bromo-2-thienyl)sulfonylamino]benzoyl]amino]ethyl-diisopropyl-ammonium Formula: C19H27BrN3O3S2+ MolecularWeight: 489.46998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(S2)Br)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(S2)Br)C(C)C

InChI

InChI=1S/C19H26BrN3O3S2/c1-13(2)23(14(3)4)12-11-21-19(24)15-5-7-16(8-6-15)22-28(25,26)18-10-9-17(20)27-18/h5-10,13-14,22H,11-12H2,1-4H3,(H,21,24)/p+1