Vitas-M small molecule compound
methyl (2E)-2-{[(8-fluoro-4-hydroxyquinolin-3-yl)carbonyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL249168
SMILES COC(=O)c1s/c(=N/C(=O)c2cnc3c(c2O)cccc3F)/[nH]c1C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H12FN3O4S MW 361.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12FN3O4S/c1-7-13(15(23)24-2)25-16(19-7)20-14(22)9-6-18-11-8(12(9)21)4-3-5-10(11)17/h3-6H,1-2H3,(H,18,21)(H,19,20,22)InChIKey
ZEDCQEPMSWPVAA-UHFFFAOYSA-NSynonyms
1401598-70-61401598706
CC1=C(SC(=N1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3F)C(=O)OC
COC(=O)c1sc(=NC(=O)c2cnc3c(c2O)cccc3F)(nH)c1C
InChI=1SC16H12FN3O4Sc1713(15(23)242)2516(197)2014(22)9618118(12(9)21)43510(11)17h36H12H3(H1821)(H192022)
methyl(2E)2(((8fluoro4hydroxyquinolin3yl)carbonyl)imino)4methyl23dihydro13thiazole5carboxylate
methyl2((8fluoro4oxo1Hquinoline3carbonyl)amino)4methyl13thiazole5carboxylate
MFCD24861447
ZINC000079482321
ZINC79482321
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