Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yloxy)-1-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]ethanone

Catalog ID
STK081551
SMILES O=C(N1c2ccccc2Sc2c1cc(cc2)C(F)(F)F)COc1nc2c(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 C22H13F3N2O2S2 MW 458.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13F3N2O2S2/c23-22(24,25)13-9-10-19-16(11-13)27(15-6-2-4-8-18(15)30-19)20(28)12-29-21-26-14-5-1-3-7-17(14)31-21/h1-11H,12H2
InChIKey
KXJVXDCTUZFLDO-UHFFFAOYSA-N
Synonyms
332019-60-0
13BENZOTHIAZOL2YL2OXO2(2(TRIFLUOROMETHYL)10HPHENOTHIAZIN10YL)ETHYLETHER
2(13BENZOTHIAZOL2YLOXY)1(2(TRIFLUOROMETHYL)10HPHENOTHIAZIN10YL)ETHANONE
2(13BENZOTHIAZOL2YLOXY)1(2(TRIFLUOROMETHYL)PHENOTHIAZIN10YL)ETHANONE
2(benzo(d)thiazol2yloxy)1(2(trifluoromethyl)10Hphenothiazin10yl)ethanone
2(BENZOTHIAZOL2YLOXY)1(2TRIFLUOROMETHYLPHENOTHIAZIN10YL)ETHANONE
332019600
C1=CC=C2C(=C1)N=C(S2)OCC(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F
InChI=1SC22H13F3N2O2S2c2322(2425)139101916(1113)27(15624818(15)3019)20(28)1229212614513717(14)3121h111H12H2
MFCD01171426
O=C(N1c2ccccc2Sc2c1cc(cc2)C(F)(F)F)COc1nc2c(s1)cccc2
STK081551
ZINC000002083563
ZINC02083563
ZINC2083563

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Available files

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