methyl-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]-[(1S)-1-(4-sulfamoylphenyl)ethyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]-[(1S)-1-(4-sulfamoylphenyl)ethyl]azanium Openeye Name: methyl-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]-[(1S)-1-(4-sulfamoylphenyl)ethyl]ammonium CAS Name: methyl-[2-oxo-2-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethyl]-[(1S)-1-(4-sulfamoylphenyl)ethyl]ammonium IUPAC Name: methyl-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]-[(1S)-1-(4-sulfamoylphenyl)ethyl]azanium Traditional Name: [2-keto-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]ammonium Formula: C20H27N4O4S+ MolecularWeight: 419.51778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)[NH+](C)CC(=O)C2=CNC(=C2)C(=O)N3CCCC3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)N)[NH+](C)CC(=O)C2=CNC(=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H26N4O4S/c1-14(15-5-7-17(8-6-15)29(21,27)28)23(2)13-19(25)16-11-18(22-12-16)20(26)24-9-3-4-10-24/h5-8,11-12,14,22H,3-4,9-10,13H2,1-2H3,(H2,21,27,28)/p+1/t14-/m0/s1