dimethyl-[(2R)-3-methyl-1-[3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanoylamino]butan-2-yl]azanium

Systemtic Name: dimethyl-[(2R)-3-methyl-1-[3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanoylamino]butan-2-yl]azanium Openeye Name: dimethyl-[(1R)-2-methyl-1-[[3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]propanoylamino]methyl]propyl]ammonium CAS Name: dimethyl-[(2R)-3-methyl-1-[[3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-1-oxopropyl]amino]butan-2-yl]ammonium IUPAC Name: dimethyl-[(2R)-3-methyl-1-[3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propanoylamino]butan-2-yl]azanium Traditional Name: dimethyl-[(1R)-2-methyl-1-[[3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)propanoylamino]methyl]propyl]ammonium Formula: C23H38N5O3S+ MolecularWeight: 464.64452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)CCC1=NC2=C(N1C)C=CC(=C2)S(=O)(=O)N3CCCCC3)[NH+](C)C

Isomeric SMILES

CC(C)[C@H](CNC(=O)CCC1=NC2=C(N1C)C=CC(=C2)S(=O)(=O)N3CCCCC3)[NH+](C)C

InChI

InChI=1S/C23H37N5O3S/c1-17(2)21(26(3)4)16-24-23(29)12-11-22-25-19-15-18(9-10-20(19)27(22)5)32(30,31)28-13-7-6-8-14-28/h9-10,15,17,21H,6-8,11-14,16H2,1-5H3,(H,24,29)/p+1/t21-/m0/s1