Vitas-M small molecule compound
2-({5-[3-(acetylamino)phenyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-bromophenyl)acetamide
Catalog ID
STK239970
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1c1cccc(c1)NC(=O)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 C20H20BrN5O2S MW 474.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrN5O2S/c1-3-26-19(14-5-4-6-17(11-14)22-13(2)27)24-25-20(26)29-12-18(28)23-16-9-7-15(21)8-10-16/h4-11H,3,12H2,1-2H3,(H,22,27)(H,23,28)InChIKey
XTWSRBRSIALKKQ-UHFFFAOYSA-NSynonyms
2((5(3(acetylamino)phenyl)4ethyl4H124triazol3yl)sulfanyl)N(4bromophenyl)acetamide
2((5(3acetamidophenyl)4ethyl124triazol3yl)sulfanyl)N(4bromophenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)C3=CC(=CC=C3)NC(=O)C
InChI=1SC20H20BrN5O2Sc132619(1454617(1114)2213(2)27)242520(26)291218(28)23169715(21)81016h411H312H212H3(H2227)(H2328)
MFCD08677670
ZINC000009226284
ZINC09226284
ZINC9226284
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