Vitas-M small molecule compound
ethyl (2E)-3-(4-methylphenyl)-2-[3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]prop-2-enoate
Catalog ID
STL177180
SMILES CCOC(=O)/C(=C\c1ccc(cc1)C)/c1sc2n(n1)c(nn2)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 C16H13F3N4O2S MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N4O2S/c1-3-25-13(24)11(8-10-6-4-9(2)5-7-10)12-22-23-14(16(17,18)19)20-21-15(23)26-12/h4-8H,3H2,1-2H3/b11-8-InChIKey
YFZAQXZHSGLMPP-FLIBITNWSA-NSynonyms
832137-92-5832137925
CCOC(=O)C(=CC1=CC=C(C=C1)C)C2=NN3C(=NN=C3S2)C(F)(F)F
CCOC(=O)C(=Cc1ccc(cc1)C)c1sc2n(n1)c(nn2)C(F)(F)F
ethyl(2E)3(4methylphenyl)2(3(trifluoromethyl)(124)triazolo(34b)(134)thiadiazol6yl)prop2enoate
ETHYL(E)3(4METHYLPHENYL)2(3(TRIFLUOROMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PROP2ENOATE
InChI=1SC16H13F3N4O2Sc132513(24)11(810649(2)5710)12222314(16(1718)19)202115(23)2612h48H3H212H3b118
MFCD04051941
ZINC000006401454
ZINC06401454
ZINC6401454
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