Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)acetamide
Catalog ID
STK569920
SMILES O=C(Nc1c(Br)cc(cc1Br)C)CSc1nnc(n1C)c1ccc(cc1)C(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 C22H24Br2N4OS MW 552.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24Br2N4OS/c1-13-10-16(23)19(17(24)11-13)25-18(29)12-30-21-27-26-20(28(21)5)14-6-8-15(9-7-14)22(2,3)4/h6-11H,12H2,1-5H3,(H,25,29)InChIKey
XNLMZOSYQABORH-UHFFFAOYSA-NSynonyms
2((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)N(26dibromo4methylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N(26DIBROMO4METHYLPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)N(26dibromo4methylphenyl)acetamide
CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C)Br
InChI=1SC22H24Br2N4OSc1131016(23)19(17(24)1113)2518(29)123021272620(28(21)5)146815(9714)22(23)4h611H12H215H3(H2529)
MFCD05539861
N(26DIBROMO4METHYLPHENYL)2(5(4(TERTBUTYL)PHENYL)4METHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001813133
ZINC01813133
ZINC1813133
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