Vitas-M small molecule compound
2-bromo-N-[(5-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]benzamide
Catalog ID
STK251241
SMILES COc1ccccc1OCCSc1nnc(n1C)CNC(=O)c1ccccc1Br
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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 C20H21BrN4O3S MW 477.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN4O3S/c1-25-18(13-22-19(26)14-7-3-4-8-15(14)21)23-24-20(25)29-12-11-28-17-10-6-5-9-16(17)27-2/h3-10H,11-13H2,1-2H3,(H,22,26)InChIKey
FQJJLHMDXAOYDF-UHFFFAOYSA-NSynonyms
2BROMON((5((2(2METHOXYPHENOXY)ETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
2BROMON((5(2(2METHOXYPHENOXY)ETHYLSULFANYL)4METHYL124TRIAZOL3YL)METHYL)BENZAMIDE
2BROMON(5(2(2METHOXYPHENOXY)ETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)BENZAMIDE
CN1C(=NN=C1SCCOC2=CC=CC=C2OC)CNC(=O)C3=CC=CC=C3Br
InChI=1SC20H21BrN4O3Sc12518(132219(26)14734815(14)21)232420(25)29121128171065916(17)272h310H1113H212H3(H2226)
MFCD08670127
ZINC000009698952
ZINC09698952
ZINC9698952
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