Vitas-M small molecule compound
(2E)-2-{2-[(2-methylbenzyl)oxy]-5-nitrobenzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK005333
SMILES Cc1ccccc1COc1ccc(cc1/C=c\1/sc2n(c1=O)c1c(n2)cccc1)[N+](=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 C24H17N3O4S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17N3O4S/c1-15-6-2-3-7-16(15)14-31-21-11-10-18(27(29)30)12-17(21)13-22-23(28)26-20-9-5-4-8-19(20)25-24(26)32-22/h2-13H,14H2,1H3/b22-13+InChIKey
IPCMIIXUZKVLAE-LPYMAVHISA-NSynonyms
(2E)2((2((2methylphenyl)methoxy)5nitrophenyl)methylidene)(13)thiazolo(32a)benzimidazol1one
(2E)2(2((2METHYLBENZYL)OXY)5NITROBENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
CC1=CC=CC=C1COC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)N4C5=CC=CC=C5N=C4S3
Cc1ccccc1COc1ccc(cc1C=c1sc2n(c1=O)c1c(n2)cccc1)(N+)(=O)(O)
InChI=1SC24H17N3O4Sc115623716(15)143121111018(27(29)30)1217(21)132223(28)2620954819(20)2524(26)3222h213H14H21H3b2213+
MFCD03184245
STK005333
ZINC000006459918
ZINC12285257
ZINC6459918
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