Vitas-M small molecule compound
(2Z)-2-[2-(difluoromethoxy)benzylidene]-5-methyl-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
Catalog ID
STL413064
SMILES FC(Oc1ccccc1/C=c/1\sc2=NC3(C(C(n2c1=O)c1ccccc1O3)C(=O)N)C)F
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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 C22H17F2N3O4S MW 457.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F2N3O4S/c1-22-16(18(25)28)17(12-7-3-5-9-14(12)31-22)27-19(29)15(32-21(27)26-22)10-11-6-2-4-8-13(11)30-20(23)24/h2-10,16-17,20H,1H3,(H2,25,28)/b15-10-InChIKey
NHUKYKGRNVDCFL-GDNBJRDFSA-NSynonyms
1354544-01-6(2Z)2(2(difluoromethoxy)benzylidene)5methyl1oxo12dihydro5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocine13carboxamide
1354544016
CC12C(C(C3=CC=CC=C3O1)N4C(=O)C(=CC5=CC=CC=C5OC(F)F)SC4=N2)C(=O)N
FC(Oc1ccccc1C=c1sc2=NC3(C(C(n2c1=O)c1ccccc1O3)C(=O)N)C)F
InChI=1SC22H17F2N3O4Sc12216(18(25)28)17(12735914(12)3122)2719(29)15(3221(27)2622)1011624813(11)3020(23)24h210161720H1H3(H22528)b1510
MFCD25971907
ZINC000107913078
ZINC000107913086
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