Vitas-M small molecule compound
3-({2-chloro-6-methoxy-4-[(E)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}methyl)benzoic acid
Catalog ID
STL504957
SMILES COc1cc(cc(c1OCc1cccc(c1)C(=O)O)Cl)/C=c\1/sc2n(c1=O)c1c(n2)cccc1
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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 C25H17ClN2O5S MW 492.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN2O5S/c1-32-20-11-15(10-17(26)22(20)33-13-14-5-4-6-16(9-14)24(30)31)12-21-23(29)28-19-8-3-2-7-18(19)27-25(28)34-21/h2-12H,13H2,1H3,(H,30,31)/b21-12+InChIKey
ARGGFLYGOMIFDV-CIAFOILYSA-NSynonyms
1000640
3((2chloro6methoxy4((~(E))(1oxo(13)thiazolo(32a)benzimidazol2ylidene)methyl)phenoxy)methyl)benzoicacid
3((2chloro6methoxy4((E)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)phenoxy)methyl)benzoicacid
InChI=1SC25H17ClN2O5Sc132201115(1017(26)22(20)33131454616(914)24(30)31)122123(29)2819832718(19)2725(28)3421h212H13H21H3(H3031)b2112+
MFCD31537875
ZINC000002076418
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