Vitas-M small molecule compound
N-(2-bromo-4,6-difluorophenyl)-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL294019
SMILES O=C(Nc1c(F)cc(cc1Br)F)CSc1nnc(n1C)c1ccc(cc1)C(C)(C)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 C21H21BrF2N4OS MW 495.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrF2N4OS/c1-21(2,3)13-7-5-12(6-8-13)19-26-27-20(28(19)4)30-11-17(29)25-18-15(22)9-14(23)10-16(18)24/h5-10H,11H2,1-4H3,(H,25,29)InChIKey
PYSUQEMXRWYHJY-UHFFFAOYSA-NSynonyms
848931-67-92(5(4(TERTBUTYL)PHENYL)4METHYL(124TRIAZOL3YLTHIO))N(2BROMO46DIFLUOROPHENYL)ACETAMIDE
848931679
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3Br)F)F
InChI=1SC21H21BrF2N4OSc121(23)137512(6813)19262720(28(19)4)301117(29)251815(22)914(23)1016(18)24h510H11H214H3(H2529)
MFCD05678306
N(2bromo46difluorophenyl)2((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)acetamide
N(2BROMO46DIFLUOROPHENYL)2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2bromo46difluorophenyl)2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)acetamide
ZINC000002444937
ZINC02444937
ZINC2444937
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