Vitas-M small molecule compound
6-ethyl-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-6H-pyrimido[5,4-c][2,1]benzothiazine 5,5-dioxide
Catalog ID
STL125878
SMILES CCN1c2ccccc2c2c(S1(=O)=O)cnc(n2)SCc1cccc(c1)C(F)(F)F
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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 C20H16F3N3O2S2 MW 451.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F3N3O2S2/c1-2-26-16-9-4-3-8-15(16)18-17(30(26,27)28)11-24-19(25-18)29-12-13-6-5-7-14(10-13)20(21,22)23/h3-11H,2,12H2,1H3InChIKey
MLCCJSSUUUHQJU-UHFFFAOYSA-NSynonyms
6ethyl2((3(trifluoromethyl)benzyl)sulfanyl)6Hpyrimido(54c)(21)benzothiazine55dioxide
6ethyl2((3(trifluoromethyl)phenyl)methylsulfanyl)pyrimido(54c)(21)benzothiazine55dioxide
CCN1C2=CC=CC=C2C3=NC(=NC=C3S1(=O)=O)SCC4=CC(=CC=C4)C(F)(F)F
InChI=1SC20H16F3N3O2S2c122616943815(16)1817(30(2627)28)112419(2518)29121365714(1013)20(2122)23h311H212H21H3
MFCD20738304
ZINC000067260080
ZINC67260080
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