Vitas-M small molecule compound
2-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-bromo-2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL379404
SMILES O=C(Nc1ccc(cc1C(F)(F)F)Br)CSc1nnc(n1C)Cc1ccccc1
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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 C19H16BrF3N4OS MW 485.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrF3N4OS/c1-27-16(9-12-5-3-2-4-6-12)25-26-18(27)29-11-17(28)24-15-8-7-13(20)10-14(15)19(21,22)23/h2-8,10H,9,11H2,1H3,(H,24,28)InChIKey
KCIRHZGMUUSXGR-UHFFFAOYSA-NSynonyms
2((5BENZYL4METHYL124TRIAZOL3YL)SULFANYL)N(4BROMO2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((5benzyl4methyl4H124triazol3yl)sulfanyl)N(4bromo2(trifluoromethyl)phenyl)acetamide
CN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)C(F)(F)F)CC3=CC=CC=C3
InChI=1SC19H16BrF3N4OSc12716(9125324612)252618(27)291117(28)24158713(20)1014(15)19(2122)23h2810H911H21H3(H2428)
MFCD03861971
ZINC000000663941
ZINC00663941
ZINC663941
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