Vitas-M small molecule compound
3-[(acetyloxy)methyl]-8-oxo-7-[({5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-2-yl}carbonyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STK384792
SMILES O=C(c1ccc(o1)COc1c(F)c(F)cc(c1F)F)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)C
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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 C22H16F4N2O8S MW 544.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F4N2O8S/c1-8(29)34-5-9-7-37-21-16(20(31)28(21)17(9)22(32)33)27-19(30)13-3-2-10(36-13)6-35-18-14(25)11(23)4-12(24)15(18)26/h2-4,16,21H,5-7H2,1H3,(H,27,30)(H,32,33)InChIKey
MRBOWIFEJAPYPE-UHFFFAOYSA-NSynonyms
1214221-02-91214221029
3((acetyloxy)methyl)8oxo7(((5((2356tetrafluorophenoxy)methyl)furan2yl)carbonyl)amino)5thia1azabicyclo(420)oct2ene2carboxylicacid
3(acetyloxymethyl)8oxo7((5((2356tetrafluorophenoxy)methyl)furan2carbonyl)amino)5thia1azabicyclo(420)oct2ene2carboxylicacid
CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C3=CC=C(O3)COC4=C(C(=CC(=C4F)F)F)F)SC1)C(=O)O
InChI=1SC22H16F4N2O8Sc18(29)34597372116(20(31)28(21)17(9)22(32)33)2719(30)133210(3613)6351814(25)11(23)412(24)15(18)26h241621H57H21H3(H2730)(H3233)
MFCD05661837
ZINC000102101477
ZINC000102101494
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