Vitas-M small molecule compound
2-bromo-N-(1-{5-[(2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}ethyl)benzamide
Catalog ID
STK136576
SMILES CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1C(NC(=O)c1ccccc1Br)C
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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 C22H20BrClF3N5O2S MW 590.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrClF3N5O2S/c1-3-32-19(12(2)28-20(34)14-6-4-5-7-15(14)23)30-31-21(32)35-11-18(33)29-17-10-13(22(25,26)27)8-9-16(17)24/h4-10,12H,3,11H2,1-2H3,(H,28,34)(H,29,33)InChIKey
YLEJRJSKRGAJCC-UHFFFAOYSA-NSynonyms
2BROMON((1R)1(5((2((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2BROMON(1(5((2((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2BROMON(1(5(2(2CHLORO5(TRIFLUOROMETHYL)ANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C(C)NC(=O)C3=CC=CC=C3Br
InChI=1SC22H20BrClF3N5O2Sc133219(12(2)2820(34)14645715(14)23)303121(32)351118(33)29171013(22(2526)27)8916(17)24h41012H311H212H3(H2834)(H2933)
MFCD04343183
ZINC000002859097
ZINC000002859098
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