Vitas-M small molecule compound
methyl [4-(4-fluorophenyl)-7-(7-methoxy-1,3-benzodioxol-5-yl)-2,5-dioxo-4,5,6,7-tetrahydro[1,3]thiazolo[4,5-b]pyridin-3(2H)-yl]acetate
Catalog ID
STL433435
SMILES COC(=O)Cn1c(=O)sc2c1N(c1ccc(cc1)F)C(=O)CC2c1cc(OC)c2c(c1)OCO2
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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 C23H19FN2O7S MW 486.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19FN2O7S/c1-30-16-7-12(8-17-20(16)33-11-32-17)15-9-18(27)26(14-5-3-13(24)4-6-14)22-21(15)34-23(29)25(22)10-19(28)31-2/h3-8,15H,9-11H2,1-2H3InChIKey
GDOGTOYCQRENRC-UHFFFAOYSA-NSynonyms
COC1=CC(=CC2=C1OCO2)C3CC(=O)N(C4=C3SC(=O)N4CC(=O)OC)C5=CC=C(C=C5)F
InChI=1SC23H19FN2O7Sc13016712(81720(16)33113217)15918(27)26(145313(24)4614)2221(15)3423(29)25(22)1019(28)312h3815H911H212H3
methyl(4(4fluorophenyl)7(7methoxy13benzodioxol5yl)25dioxo4567tetrahydro(13)thiazolo(45b)pyridin3(2H)yl)acetate
methyl2(4(4fluorophenyl)7(7methoxy13benzodioxol5yl)25dioxo67dihydro(13)thiazolo(45b)pyridin3yl)acetate
MFCD25975837
ZINC000066089739
ZINC000066089740
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