Vitas-M small molecule compound

N-benzyl-N-{2-[(2,4-dimethoxyphenyl)amino]-2-oxo-1-(1,2,3-thiadiazol-4-yl)ethyl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide

Catalog ID
STL447091
SMILES COc1ccc(c(c1)OC)NC(=O)C(N(C(=O)CN1C(=O)c2c(C1=O)cccc2)Cc1ccccc1)c1nnsc1

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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 C29H25N5O6S MW 571.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5O6S/c1-39-19-12-13-22(24(14-19)40-2)30-27(36)26(23-17-41-32-31-23)33(15-18-8-4-3-5-9-18)25(35)16-34-28(37)20-10-6-7-11-21(20)29(34)38/h3-14,17,26H,15-16H2,1-2H3,(H,30,36)
InChIKey
HTDAAHAKFUNYBI-UHFFFAOYSA-N
Synonyms

2(BENZYL(2(13DIOXOISOINDOL2YL)ACETYL)AMINO)N(24DIMETHOXYPHENYL)2(THIADIAZOL4YL)ACETAMIDE
COC1=CC(=C(C=C1)NC(=O)C(C2=CSN=N2)N(CC3=CC=CC=C3)C(=O)CN4C(=O)C5=CC=CC=C5C4=O)OC
InChI=1SC29H25N5O6Sc13919121322(24(1419)402)3027(36)26(231741323123)33(15188435918)25(35)163428(37)2010671121(20)29(34)38h3141726H1516H212H3(H3036)
MFCD06242575
NbenzylN(2((24dimethoxyphenyl)amino)2oxo1(123thiadiazol4yl)ethyl)2(13dioxo13dihydro2Hisoindol2yl)acetamide
NBENZYLN(2(24DIMETHOXYPHENYLAMINO)2OXO1(123THIADIAZOL4YL)ETHYL)2(13DIOXOISOINDOLIN2YL)ACETAMIDE
ZINC000008748565
ZINC000008748570

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Available files

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