Vitas-M small molecule compound

2-{2-[(2-fluorobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-1H-isoindole-1,3(2H)-dione

Catalog ID
STK724100
SMILES Fc1ccccc1CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cccc2

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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 C22H13FN2O2S2 MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13FN2O2S2/c23-17-8-4-1-5-13(17)12-28-22-24-18-10-9-14(11-19(18)29-22)25-20(26)15-6-2-3-7-16(15)21(25)27/h1-11H,12H2
InChIKey
WMZRKKHORGIITJ-UHFFFAOYSA-N
Synonyms

2(2((2fluorobenzyl)sulfanyl)13benzothiazol6yl)1Hisoindole13(2H)dione
2(2((2FLUOROPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)ISOINDOLE13DIONE
C1=CC=C(C(=C1)CSC2=NC3=C(S2)C=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O)F
InChI=1SC22H13FN2O2S2c2317841513(17)122822241810914(1119(18)2922)2520(26)15623716(15)21(25)27h111H12H2
MFCD01429443
ZINC000001061942
ZINC01061942
ZINC1061942

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Available files

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