Vitas-M small molecule compound

N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-methylpentanamide

Catalog ID
STK847812
SMILES CC(CC(N1C(=O)c2c(C1=O)cccc2)C(=O)/N=c\1/sc2c([nH]1)cccc2)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 C21H19N3O3S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3S/c1-12(2)11-16(24-19(26)13-7-3-4-8-14(13)20(24)27)18(25)23-21-22-15-9-5-6-10-17(15)28-21/h3-10,12,16H,11H2,1-2H3,(H,22,23,25)
InChIKey
BSQKQRUBYWJFPQ-UHFFFAOYSA-N
Synonyms
329909-90-2
329909902
CC(CC(N1C(=O)c2c(C1=O)cccc2)C(=O)N=c1sc2c((nH)1)cccc2)C
MFCD07199722
N((2E)13benzothiazol2(3H)ylidene)2(13dioxo13dihydro2Hisoindol2yl)4methylpentanamide
N(13BENZOTHIAZOL2YL)2(13DIOXOISOINDOL2YL)4METHYLPENTANAMIDE
ZINC000009109080
ZINC000009109081

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Available files

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