Vitas-M small molecule compound
N-(4-bromo-3-methylphenyl)-2-{[4-ethyl-5-(4-methoxybenzyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK117544
SMILES COc1ccc(cc1)Cc1nnc(n1CC)SCC(=O)Nc1ccc(c(c1)C)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 C21H23BrN4O2S MW 475.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4O2S/c1-4-26-19(12-15-5-8-17(28-3)9-6-15)24-25-21(26)29-13-20(27)23-16-7-10-18(22)14(2)11-16/h5-11H,4,12-13H2,1-3H3,(H,23,27)InChIKey
LNLNHKZKFVHZNY-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Br)C)CC3=CC=C(C=C3)OC
InChI=1SC21H23BrN4O2Sc142619(12155817(283)9615)242521(26)291320(27)231671018(22)14(2)1116h511H41213H213H3(H2327)
MFCD03995196
N(4BROMO3METHYLPHENYL)2((4ETHYL5((4METHOXYPHENYL)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO3METHYLPHENYL)2((4ETHYL5(4METHOXYBENZYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001142316
ZINC01142316
ZINC1142316
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