[(2R)-1-[[1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonylpiperidin-4-yl]carbonylamino]-3-methyl-butan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-1-[[1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonylpiperidin-4-yl]carbonylamino]-3-methyl-butan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-[[[1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonylpiperidine-4-carbonyl]amino]methyl]-2-methyl-propyl]-dimethyl-ammonium CAS Name: [(2R)-1-[[[1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-4-piperidinyl]-oxomethyl]amino]-3-methylbutan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-[[1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylpiperidine-4-carbonyl]amino]-3-methylbutan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-[[[1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonylisonipecotoyl]amino]methyl]-2-methyl-propyl]-dimethyl-ammonium Formula: C19H34N5O4S+ MolecularWeight: 428.56936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)[NH+](C)C

Isomeric SMILES

CC(C)[C@H](CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)[NH+](C)C

InChI

InChI=1S/C19H33N5O4S/c1-13(2)17(22(3)4)11-21-19(26)14-6-8-24(9-7-14)29(27,28)15-10-16(18(20)25)23(5)12-15/h10,12-14,17H,6-9,11H2,1-5H3,(H2,20,25)(H,21,26)/p+1/t17-/m0/s1