N-[(2S)-1-[[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)anilino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)anilino]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)anilino]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)anilino]ethyl]-2-furamide Formula: C18H21N4O5S+ MolecularWeight: 405.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=[NH+]CCC2)NC(=O)C3=CC=CO3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=[NH+]CCC2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H20N4O5S/c1-12(20-18(24)15-7-4-10-27-15)17(23)21-13-5-2-6-14(11-13)28(25,26)22-16-8-3-9-19-16/h2,4-7,10-12H,3,8-9H2,1H3,(H,19,22)(H,20,24)(H,21,23)/p+1/t12-/m0/s1