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CHEBI:105790 - 2-[[[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester

ChEBI IDCHEBI:105790
ChEBI Name2-[[[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester
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FormulaC28H25N3O5S
Net Charge0
Average Mass515.591
Monoisotopic Mass515.15149
SMILESCOC(=O)c1ccccc1NC(=S)N(Cc1ccc2c(c1)OCO2)Cc1cc2cc(C)ccc2nc1=O
InChIInChI=1S/C28H25N3O5S/c1-17-7-9-22-19(11-17)13-20(26(32)29-22)15-31(14-18-8-10-24-25(12-18)36-16-35-24)28(37)30-23-6-4-3-5-21(23)27(33)34-2/h3-13H,14-16H2,1-2H3,(H,29,32)(H,30,37)
InChIKeyJEPRCTSVMYRURE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[[1,3-benzodioxol-5-ylmethyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester (CHEBI:105790) is a quinolines (CHEBI:26513)
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