Vitas-M small molecule compound

2-{[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-1-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]ethanone

Catalog ID
STK679137
SMILES O=C(N1c2ccccc2Sc2c1cc(cc2)C(F)(F)F)CSc1nnnn1c1ccc2c(c1)OCO2

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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 C23H14F3N5O3S2 MW 529.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14F3N5O3S2/c24-23(25,26)13-5-8-20-16(9-13)30(15-3-1-2-4-19(15)36-20)21(32)11-35-22-27-28-29-31(22)14-6-7-17-18(10-14)34-12-33-17/h1-10H,11-12H2
InChIKey
AUCUIINBKJBNFL-UHFFFAOYSA-N
Synonyms

2((1(13benzodioxol5yl)1Htetrazol5yl)sulfanyl)1(2(trifluoromethyl)10Hphenothiazin10yl)ethanone
2(1(13BENZODIOXOL5YL)TETRAZOL5YL)SULFANYL1(2(TRIFLUOROMETHYL)PHENOTHIAZIN10YL)ETHANONE
C1OC2=C(O1)C=C(C=C2)N3C(=NN=N3)SCC(=O)N4C5=CC=CC=C5SC6=C4C=C(C=C6)C(F)(F)F
InChI=1SC23H14F3N5O3S2c2423(2526)13582016(913)30(15312419(15)3620)21(32)11352227282931(22)14671718(1014)34123317h110H1112H2
MFCD03408521
ZINC000000719286
ZINC719286

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Available files

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