Vitas-M small molecule compound
N-(2-bromo-4-methylphenyl)-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL057416
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2Br)C)nnc1c1ccc(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 C28H29BrN4O2S MW 565.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29BrN4O2S/c1-18-6-15-24(23(29)16-18)30-25(34)17-36-27-32-31-26(19-7-9-20(10-8-19)28(2,3)4)33(27)21-11-13-22(35-5)14-12-21/h6-16H,17H2,1-5H3,(H,30,34)InChIKey
JJYCJYITFQSDIY-UHFFFAOYSA-NSynonyms
477313-56-72(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(2BROMO4METHYLPHENYL)ACETAMIDE
477313567
CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)C(C)(C)C)Br
InChI=1SC28H29BrN4O2Sc11861524(23(29)1618)3025(34)173627323126(197920(10819)28(23)4)33(27)21111322(355)141221h616H17H215H3(H3034)
MFCD03474108
N(2BROMO4METHYLPHENYL)2((5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)THIO)ACETAMIDE
N(2BROMO4METHYLPHENYL)2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2bromo4methylphenyl)2((5(4tertbutylphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000001796303
ZINC01796303
ZINC1796303
Check stock
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Check stock on Vitas-MAvailable files
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