Vitas-M small molecule compound
N-(4-bromo-2-ethyl-6-methylphenyl)-2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK111504
SMILES CCc1cc(Br)cc(c1NC(=O)CSc1nnc(n1c1cccc(c1)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 C21H23BrN4OS MW 459.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4OS/c1-5-16-11-17(22)10-14(3)20(16)23-19(27)12-28-21-25-24-15(4)26(21)18-8-6-7-13(2)9-18/h6-11H,5,12H2,1-4H3,(H,23,27)InChIKey
ZDBZDMQJKHJMAK-UHFFFAOYSA-NSynonyms
CCC1=C(C(=CC(=C1)Br)C)NC(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C)C
InChI=1SC21H23BrN4OSc15161117(22)1014(3)20(16)2319(27)122821252415(4)26(21)1886713(2)918h611H512H214H3(H2327)
MFCD04127562
N(4BROMO2ETHYL6METHYLPHENYL)2((5METHYL4(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO2ETHYL6METHYLPHENYL)2((5METHYL4(3METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000009296217
ZINC09296217
ZINC9296217
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