Vitas-M small molecule compound
N-(2-bromo-4,6-difluorophenyl)-2-({5-[(2-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STL122921
SMILES C=CCn1c(SCC(=O)Nc2c(F)cc(cc2Br)F)nnc1COc1ccccc1Cl
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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 C20H16BrClF2N4O2S MW 529.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClF2N4O2S/c1-2-7-28-17(10-30-16-6-4-3-5-14(16)22)26-27-20(28)31-11-18(29)25-19-13(21)8-12(23)9-15(19)24/h2-6,8-9H,1,7,10-11H2,(H,25,29)InChIKey
FYXPKGNPEJZTTI-UHFFFAOYSA-NSynonyms
C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2Br)F)F)COC3=CC=CC=C3Cl
InChI=1SC20H16BrClF2N4O2Sc1272817(103016643514(16)22)262720(28)311118(29)251913(21)812(23)915(19)24h2689H171011H2(H2529)
MFCD05993401
N(2bromo46difluorophenyl)2((5((2chlorophenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(2BROMO46DIFLUOROPHENYL)2((5((2CHLOROPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002861799
ZINC2861799
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