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CHEBI:44274 - 1-methyl-5-(2-phenoxymethylpyrrolidine-1-sulfonyl)-1H-indole-2,3-dione

ChEBI IDCHEBI:44274
ChEBI Name1-methyl-5-(2-phenoxymethylpyrrolidine-1-sulfonyl)-1H-indole-2,3-dione
Stars
ASCII Name1-methyl-5-(2-phenoxymethylpyrrolidine-1-sulfonyl)-1H-indole-2,3-dione
Last Modified17 October 2009
DownloadsMolfile
FormulaC20H20N2O5S
Net Charge0
Average Mass400.456
Monoisotopic Mass400.10929
SMILES[H]c1c([H])c([H])c(OC([H])([H])[C@@]2([H])N(S(=O)(=O)c3c([H])c([H])c4c(c3[H])C(=O)C(=O)N4C([H])([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H]
InChIInChI=1S/C20H20N2O5S/c1-21-18-10-9-16(12-17(18)19(23)20(21)24)28(25,26)22-11-5-6-14(22)13-27-15-7-3-2-4-8-15/h2-4,7-10,12,14H,5-6,11,13H2,1H3/t14-/m0/s1
InChIKeyPFAYCUAUBOGVDX-AWEZNQCLSA-N
ChEBI Ontology
Outgoing Relation(s)
1-methyl-5-(2-phenoxymethylpyrrolidine-1-sulfonyl)-1H-indole-2,3-dione (CHEBI:44274) has functional parent isatin (CHEBI:27539)
1-methyl-5-(2-phenoxymethylpyrrolidine-1-sulfonyl)-1H-indole-2,3-dione (CHEBI:44274) is a sulfonamide (CHEBI:35358)
Synonyms  Source
1-methyl-5-{[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl}-1H-indole-2,3-dionePDBeChem
1-METHYL-5-(2-PHENOXYMETHYL-PYRROLIDINE-1-SULFONYL)-1H-INDOLE-2,3-DIONEPDBeChem
Manual XrefsDatabases
MSIPDBeChem