Vitas-M small molecule compound
methyl (2Z)-2-{4-methoxy-3-[(2,3,5,6-tetrafluorophenoxy)methyl]benzylidene}-5-methyl-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxylate
Catalog ID
STL173654
SMILES COC(=O)C1C2c3ccccc3OC1(C)N=c1n2c(=O)/c(=C/c2ccc(c(c2)COc2c(F)c(F)cc(c2F)F)OC)/s1
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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 C30H22F4N2O6S MW 614.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22F4N2O6S/c1-30-22(28(38)40-3)25(16-6-4-5-7-20(16)42-30)36-27(37)21(43-29(36)35-30)11-14-8-9-19(39-2)15(10-14)13-41-26-23(33)17(31)12-18(32)24(26)34/h4-12,22,25H,13H2,1-3H3/b21-11-InChIKey
IJHREUAQJHSTGN-NHDPSOOVSA-NSynonyms
492426-82-1492426821
CC12C(C(C3=CC=CC=C3O1)N4C(=O)C(=CC5=CC(=C(C=C5)OC)COC6=C(C(=CC(=C6F)F)F)F)SC4=N2)C(=O)OC
COC(=O)C1C2c3ccccc3OC1(C)N=c1n2c(=O)c(=Cc2ccc(c(c2)COc2c(F)c(F)cc(c2F)F)OC)s1
InChI=1SC30H22F4N2O6Sc13022(28(38)403)25(16645720(16)4230)3627(37)21(4329(36)3530)11148919(392)15(1014)13412623(33)17(31)1218(32)24(26)34h4122225H13H213H3b2111
methyl(2Z)2(4methoxy3((2356tetrafluorophenoxy)methyl)benzylidene)5methyl1oxo12dihydro5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocine13carboxylate
MFCD02243461
ZINC000102834541
ZINC000102834545
Check stock
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