Vitas-M small molecule compound
2-[5-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-N-(2,3-dichlorophenyl)acetamide
Catalog ID
STK186770
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1CC(=O)Nc1cccc(c1Cl)Cl
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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 C20H18BrCl2N5O2S MW 543.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrCl2N5O2S/c1-2-28-16(10-17(29)25-15-5-3-4-14(22)19(15)23)26-27-20(28)31-11-18(30)24-13-8-6-12(21)7-9-13/h3-9H,2,10-11H2,1H3,(H,24,30)(H,25,29)InChIKey
ZMZZRODFDXBPPK-UHFFFAOYSA-NSynonyms
2(5((2((4BROMOPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)N(23DICHLOROPHENYL)ACETAMIDE
2(5((4BROMOPHENYLCARBAMOYL)METHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)N(23DICHLOROPHENYL)ACETAMIDE
2(5(2(4BROMOANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(23DICHLOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)CC(=O)NC3=C(C(=CC=C3)Cl)Cl
InChI=1SC20H18BrCl2N5O2Sc122816(1017(29)251553414(22)19(15)23)262720(28)311118(30)24138612(21)7913h39H21011H21H3(H2430)(H2529)
MFCD05998950
ZINC000002867083
ZINC2867083
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