Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]phenyl acetate
Catalog ID
STK544987
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(s2)SCc2ccc(cc2)C)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 C22H22N4O4S3 MW 502.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S3/c1-14-4-6-16(7-5-14)12-31-21-25-26-22(33-21)32-13-20(28)24-23-11-17-8-9-18(30-15(2)27)19(10-17)29-3/h4-11H,12-13H2,1-3H3,(H,24,28)/b23-11+InChIKey
JQGDTNBIWKPWKO-FOKLQQMPSA-NSynonyms
497243-71-7(2METHOXY4((E)((2((5((4METHYLPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYL)ACETATE
(E)2methoxy4((2(2((5((4methylbenzyl)thio)134thiadiazol2yl)thio)acetyl)hydrazono)methyl)phenylacetate
2methoxy4((E)(2(((5((4methylbenzyl)sulfanyl)134thiadiazol2yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenylacetate
4((1E)2(2(5((4METHYLPHENYL)METHYLTHIO)(134THIADIAZOL2YLTHIO))ACETYLAMINO)2AZAVINYL)2METHOXYPHENYLACETATE
497243717
CC1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)NN=CC3=CC(=C(C=C3)OC(=O)C)OC
COc1cc(C=NNC(=O)CSc2nnc(s2)SCc2ccc(cc2)C)ccc1OC(=O)C
InChI=1SC22H22N4O4S3c1144616(7514)123121252622(3321)321320(28)242311178918(3015(2)27)19(1017)293h411H1213H213H3(H2428)b2311+
MFCD03300264
ZINC000001774163
ZINC33343186
Check stock
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Check stock on Vitas-MAvailable files
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