Vitas-M small molecule compound
2-({4-benzyl-5-[(4-bromophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Catalog ID
STL112210
SMILES O=C(Nc1ccc(cc1)C)CSc1nnc(n1Cc1ccccc1)COc1ccc(cc1)Br
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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 C25H23BrN4O2S MW 523.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN4O2S/c1-18-7-11-21(12-8-18)27-24(31)17-33-25-29-28-23(16-32-22-13-9-20(26)10-14-22)30(25)15-19-5-3-2-4-6-19/h2-14H,15-17H2,1H3,(H,27,31)InChIKey
GZOOXVQEFYMWMO-UHFFFAOYSA-NSynonyms
538337-01-82((4BENZYL5((4BROMOPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((4benzyl5((4bromophenoxy)methyl)4H124triazol3yl)sulfanyl)N(4methylphenyl)acetamide
2((4BENZYL5((4BROMOPHENOXY)METHYL)4H124TRIAZOL3YL)THIO)N(PTOLYL)ACETAMIDE
2(5((4BROMOPHENOXY)METHYL)4BENZYL(124TRIAZOL3YLTHIO))N(4METHYLPHENYL)ACETAMIDE
538337018
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)COC4=CC=C(C=C4)Br
InChI=1SC25H23BrN4O2Sc11871121(12818)2724(31)173325292823(16322213920(26)101422)30(25)15195324619h214H1517H21H3(H2731)
MFCD05154821
ZINC000002544618
ZINC2544618
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