dimethyl-[(2R)-3-methyl-1-[2-[4-(thiophen-2-ylsulfonylamino)phenyl]ethanoylamino]butan-2-yl]azanium

Systemtic Name: dimethyl-[(2R)-3-methyl-1-[2-[4-(thiophen-2-ylsulfonylamino)phenyl]ethanoylamino]butan-2-yl]azanium Openeye Name: dimethyl-[(1R)-2-methyl-1-[[[2-[4-(2-thienylsulfonylamino)phenyl]acetyl]amino]methyl]propyl]ammonium CAS Name: dimethyl-[(2R)-3-methyl-1-[[1-oxo-2-[4-(thiophen-2-ylsulfonylamino)phenyl]ethyl]amino]butan-2-yl]ammonium IUPAC Name: dimethyl-[(2R)-3-methyl-1-[[2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetyl]amino]butan-2-yl]azanium Traditional Name: dimethyl-[(1R)-2-methyl-1-[[[2-[4-(2-thienylsulfonylamino)phenyl]acetyl]amino]methyl]propyl]ammonium Formula: C19H28N3O3S2+ MolecularWeight: 410.57392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2)[NH+](C)C

Isomeric SMILES

CC(C)[C@H](CNC(=O)CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2)[NH+](C)C

InChI

InChI=1S/C19H27N3O3S2/c1-14(2)17(22(3)4)13-20-18(23)12-15-7-9-16(10-8-15)21-27(24,25)19-6-5-11-26-19/h5-11,14,17,21H,12-13H2,1-4H3,(H,20,23)/p+1/t17-/m0/s1