Vitas-M small molecule compound
N-(4-bromo-2-fluorophenyl)-2-({5-[(4-ethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK143748
SMILES CCc1ccc(cc1)OCc1nnc(n1C)SCC(=O)Nc1ccc(cc1F)Br
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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 C20H20BrFN4O2S MW 479.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrFN4O2S/c1-3-13-4-7-15(8-5-13)28-11-18-24-25-20(26(18)2)29-12-19(27)23-17-9-6-14(21)10-16(17)22/h4-10H,3,11-12H2,1-2H3,(H,23,27)InChIKey
KXVASUMDTBCUGN-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)OCC2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3)Br)F
InChI=1SC20H20BrFN4O2Sc13134715(8513)281118242520(26(18)2)291219(27)23179614(21)1016(17)22h410H31112H212H3(H2327)
MFCD04151093
N(4BROMO2FLUOROPHENYL)2((5((4ETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO2FLUOROPHENYL)2((5((4ETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000000682084
ZINC00682084
ZINC682084
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