Vitas-M small molecule compound
N-(4-bromo-2,6-dimethylphenyl)-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK037058
SMILES CCn1c(SCC(=O)Nc2c(C)cc(cc2C)Br)nnc1c1ccc(cc1)OC
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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/c1-5-26-20(15-6-8-17(28-4)9-7-15)24-25-21(26)29-12-18(27)23-19-13(2)10-16(22)11-14(19)3/h6-11H,5,12H2,1-4H3,(H,23,27)InChIKey
INHOALQBRPFATA-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2C)Br)C)C3=CC=C(C=C3)OC
CCn1c(SCC(=O)Nc2c(C)cc(cc2C)Br)nnc1c1ccc(cc1)OC
InChI=1SC21H23BrN4O2Sc152620(156817(284)9715)242521(26)291218(27)231913(2)1016(22)1114(19)3h611H512H214H3(H2327)
MFCD03564453
N(4BROMO26DIMETHYLPHENYL)2((4ETHYL5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO26DIMETHYLPHENYL)2((4ETHYL5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
STK037058
ZINC000001129917
ZINC01129917
ZINC1129917
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