Vitas-M small molecule compound
methyl (2E)-2-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]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
STL176601
SMILES COC(=O)C1C2c3ccccc3OC1(C)N=c1n2c(=O)/c(=C\c2ccc(c(c2)COc2cccc(c2)C(F)(F)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 C31H25F3N2O6S MW 610.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25F3N2O6S/c1-30-25(28(38)40-3)26(21-9-4-5-10-23(21)42-30)36-27(37)24(43-29(36)35-30)14-17-11-12-22(39-2)18(13-17)16-41-20-8-6-7-19(15-20)31(32,33)34/h4-15,25-26H,16H2,1-3H3/b24-14+InChIKey
VSVYPMWAOSIXJZ-ZVHZXABRSA-NSynonyms
1025310-19-31025310193
CC12C(C(C3=CC=CC=C3O1)N4C(=O)C(=CC5=CC(=C(C=C5)OC)COC6=CC=CC(=C6)C(F)(F)F)SC4=N2)C(=O)OC
COC(=O)C1C2c3ccccc3OC1(C)N=c1n2c(=O)c(=Cc2ccc(c(c2)COc2cccc(c2)C(F)(F)F)OC)s1
InChI=1SC31H25F3N2O6Sc13025(28(38)403)26(219451023(21)4230)3627(37)24(4329(36)3530)1417111222(392)18(1317)16412086719(1520)31(3233)34h4152526H16H213H3b2414+
methyl(2E)2(4methoxy3((3(trifluoromethyl)phenoxy)methyl)benzylidene)5methyl1oxo12dihydro5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocine13carboxylate
MFCD04049706
ZINC000102442310
ZINC000102442320
Check stock
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