Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-6-ethyl-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4H-chromen-4-one

Catalog ID
STK888552
SMILES CCC1CCCCN1Cc1c(O)c(CC)cc2c1occ(c2=O)c1nc2c(s1)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 C26H28N2O3S MW 448.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3S/c1-3-16-13-18-24(30)20(26-27-21-10-5-6-11-22(21)32-26)15-31-25(18)19(23(16)29)14-28-12-8-7-9-17(28)4-2/h5-6,10-11,13,15,17,29H,3-4,7-9,12,14H2,1-2H3
InChIKey
VCRHLVZKHTUHEI-UHFFFAOYSA-N
Synonyms
637747-31-0
3(13benzothiazol2yl)6ethyl8((2ethylpiperidin1yl)methyl)7hydroxy4Hchromen4one
3(benzo(d)thiazol2yl)6ethyl8((2ethylpiperidin1yl)methyl)7hydroxy4Hchromen4one
637747310
CCC1CCCCN1CC2=C3C(=CC(=C2O)CC)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4
InChI=1SC26H28N2O3Sc1316131824(30)20(26272110561122(21)3226)153125(18)19(23(16)29)14281287917(28)42h56101113151729H34791214H212H3

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Available files

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