CHEBI:96647 - N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-thiophenesulfonamide

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ChEBI Name N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-thiophenesulfonamide
ChEBI ID CHEBI:96647
Stars This entity has been manually annotated by a third party.
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Formula C19H25N3O5S2
Net Charge 0
Average Mass 439.552
Monoisotopic Mass 439.12356
InChI InChI=1S/C19H25N3O5S2/c1-13-10-22(14(2)12-23)19(24)15-6-4-8-20-18(15)27-16(13)11-21(3)29(25,26)17-7-5-9-28-17/h4-9,13-14,16,23H,10-12H2,1-3H3/t13-,14+,16-/m0/s1
InChIKey FCRAAGKQWSLNPW-LZWOXQAQSA-N
SMILES C[C@H]1CN(C(=O)C2=C(N=CC=C2)O[C@H]1CN(C)S(=O)(=O)C3=CC=CS3)[C@H](C)CO
ChEBI Ontology
Outgoing N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-thiophenesulfonamide (CHEBI:96647) is a aromatic ether (CHEBI:35618)
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