Vitas-M small molecule compound
3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]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
STK288954
SMILES O=C1C(NC(=O)c2ccc(o2)COc2c(F)c(F)cc(c2F)F)C2N1C(=C(CS2)CSc1nnc(s1)C)C(=O)O
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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 C23H16F4N4O6S3 MW 616.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F4N4O6S3/c1-8-29-30-23(40-8)39-7-9-6-38-21-16(20(33)31(21)17(9)22(34)35)28-19(32)13-3-2-10(37-13)5-36-18-14(26)11(24)4-12(25)15(18)27/h2-4,16,21H,5-7H2,1H3,(H,28,32)(H,34,35)InChIKey
LPDOFRDFUJHKKS-UHFFFAOYSA-NSynonyms
1214237-31-61214237316
3(((5methyl134thiadiazol2yl)sulfanyl)methyl)8oxo7(((5((2356tetrafluorophenoxy)methyl)furan2yl)carbonyl)amino)5thia1azabicyclo(420)oct2ene2carboxylicacid
3((5methyl134thiadiazol2yl)sulfanylmethyl)8oxo7((5((2356tetrafluorophenoxy)methyl)furan2carbonyl)amino)5thia1azabicyclo(420)oct2ene2carboxylicacid
CC1=NN=C(S1)SCC2=C(N3C(C(C3=O)NC(=O)C4=CC=C(O4)COC5=C(C(=CC(=C5F)F)F)F)SC2)C(=O)O
InChI=1SC23H16F4N4O6S3c18293023(408)39796382116(20(33)31(21)17(9)22(34)35)2819(32)133210(3713)5361814(26)11(24)412(25)15(18)27h241621H57H21H3(H2832)(H3435)
MFCD04132756
ZINC000150385909
ZINC000150385915
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