Vitas-M small molecule compound
methyl 4-(dimethylamino)-8-nitro-2-(trifluoromethyl)-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2-carboxylate
Catalog ID
STK691162
SMILES COC(=O)C1(N=C(N(C)C)n2c(=N1)sc1c2ccc(c1)[N+](=O)[O-])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 C14H12F3N5O4S MW 403.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12F3N5O4S/c1-20(2)11-18-13(10(23)26-3,14(15,16)17)19-12-21(11)8-5-4-7(22(24)25)6-9(8)27-12/h4-6H,1-3H3InChIKey
WCVCUPYTTYJIQF-UHFFFAOYSA-NSynonyms
CN(C)C1=NC(N=C2N1C3=C(S2)C=C(C=C3)(N+)(=O)(O))(C(=O)OC)C(F)(F)F
COC(=O)C1(N=C(N(C)C)n2c(=N1)sc1c2ccc(c1)(N+)(=O)(O))C(F)(F)F
InChI=1SC14H12F3N5O4Sc120(2)111813(10(23)26314(1516)17)191221(11)8547(22(24)25)69(8)2712h46H13H3
methyl4(dimethylamino)8nitro2(trifluoromethyl)(135)triazino(21b)(13)benzothiazole2carboxylate
methyl4(dimethylamino)8nitro2(trifluoromethyl)2H(135)triazino(21b)(13)benzothiazole2carboxylate
MFCD06018522
ZINC000012413915
ZINC000012413917
Check stock
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Check stock on Vitas-MAvailable files
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