Vitas-M small molecule compound
N-(4-bromo-2-methylphenyl)-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STL057314
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Br)nnc1COc1ccc(cc1)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 C27H27BrN4O3S MW 567.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrN4O3S/c1-4-34-22-12-8-21(9-13-22)32-25(16-35-23-10-5-18(2)6-11-23)30-31-27(32)36-17-26(33)29-24-14-7-20(28)15-19(24)3/h5-15H,4,16-17H2,1-3H3,(H,29,33)InChIKey
CKCGXJBMFLFLNM-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)Br)C)COC4=CC=C(C=C4)C
InChI=1SC27H27BrN4O3Sc14342212821(91322)3225(16352310518(2)61123)303127(32)361726(33)292414720(28)1519(24)3h515H41617H213H3(H2933)
MFCD07210231
N(4bromo2methylphenyl)2((4(4ethoxyphenyl)5((4methylphenoxy)methyl)124triazol3yl)sulfanyl)acetamide
N(4bromo2methylphenyl)2((4(4ethoxyphenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(4bromo2methylphenyl)2((4(4ethoxyphenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(4BROMO2METHYLPHENYL)2((4(4ETHOXYPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO2METHYLPHENYL)2(4(4ETHOXYPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000097958452
ZINC97958452
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