Vitas-M small molecule compound
2-[5-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)acetamide
Catalog ID
STK197781
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1CC(=O)Nc1ccc(cc1)F
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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 C20H19BrFN5O2S MW 492.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrFN5O2S/c1-2-27-17(11-18(28)23-16-9-5-14(22)6-10-16)25-26-20(27)30-12-19(29)24-15-7-3-13(21)4-8-15/h3-10H,2,11-12H2,1H3,(H,23,28)(H,24,29)InChIKey
LVRYRHJQJLZBNE-UHFFFAOYSA-NSynonyms
2(5((2((4BROMOPHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)N(4FLUOROPHENYL)ACETAMIDE
2(5(2(4BROMOANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(4FLUOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)CC(=O)NC3=CC=C(C=C3)F
InChI=1SC20H19BrFN5O2Sc122717(1118(28)23169514(22)61016)252620(27)301219(29)24157313(21)4815h310H21112H21H3(H2328)(H2429)
MFCD06622250
ZINC000002867092
ZINC02867092
ZINC2867092
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