Vitas-M small molecule compound
2-(4-bromo-2-tert-butylphenoxy)-N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Catalog ID
STK848739
SMILES CCc1n[nH]/c(=N\C(=O)COc2ccc(cc2C(C)(C)C)Br)/s1
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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 C16H20BrN3O2S MW 398.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20BrN3O2S/c1-5-14-19-20-15(23-14)18-13(21)9-22-12-7-6-10(17)8-11(12)16(2,3)4/h6-8H,5,9H2,1-4H3,(H,18,20,21)InChIKey
VKMUBBIFDYJIII-UHFFFAOYSA-NSynonyms
371212-05-42(4bromo2tertbutylphenoxy)N((2E)5ethyl134thiadiazol2(3H)ylidene)acetamide
371212054
CCC1=NN=C(S1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C
CCc1n(nH)c(=NC(=O)COc2ccc(cc2C(C)(C)C)Br)s1
InChI=1SC16H20BrN3O2Sc1514192015(2314)1813(21)922127610(17)811(12)16(23)4h68H59H214H3(H182021)
MFCD07211381
ZINC000009320535
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