Vitas-M small molecule compound

4-{(E)-[2-({[1-(2-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate

Catalog ID
STK791345
SMILES COc1cc(/C=N/NC(=O)CSc2nc3c(n2Cc2ccccc2Cl)cccc3)ccc1OC(=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 C26H23ClN4O4S MW 523.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN4O4S/c1-17(32)35-23-12-11-18(13-24(23)34-2)14-28-30-25(33)16-36-26-29-21-9-5-6-10-22(21)31(26)15-19-7-3-4-8-20(19)27/h3-14H,15-16H2,1-2H3,(H,30,33)/b28-14+
InChIKey
LHNQKVIVVOQJLL-CCVNUDIWSA-N
Synonyms
315222-45-8
(4((E)((2(1((2chlorophenyl)methyl)benzimidazol2yl)sulfanylacetyl)hydrazinylidene)methyl)2methoxyphenyl)acetate
(E)4((2(2((1(2chlorobenzyl)1Hbenzo(d)imidazol2yl)thio)acetyl)hydrazono)methyl)2methoxyphenylacetate
315222458
4((1E)2(2(1((2CHLOROPHENYL)METHYL)BENZIMIDAZOL2YLTHIO)ACETYLAMINO)2AZAVINYL)2METHOXYPHENYLACETATE
4((E)(2(((1(2chlorobenzyl)1Hbenzimidazol2yl)sulfanyl)acetyl)hydrazinylidene)methyl)2methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3N2CC4=CC=CC=C4Cl)OC
COc1cc(C=NNC(=O)CSc2nc3c(n2Cc2ccccc2Cl)cccc3)ccc1OC(=O)C
InChI=1SC26H23ClN4O4Sc117(32)3523121118(1324(23)342)14283025(33)16362629219561022(21)31(26)1519734820(19)27h314H1516H212H3(H3033)b2814+
MFCD02076995
ZINC000002239376
ZINC38205861

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.