Vitas-M small molecule compound
2-[5-({2-[(4-bromo-2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-(2-ethylphenyl)acetamide
Catalog ID
STK297200
SMILES CCc1ccccc1NC(=O)Cc1nnc(n1C)SCC(=O)Nc1ccc(cc1F)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 C21H21BrFN5O2S MW 506.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrFN5O2S/c1-3-13-6-4-5-7-16(13)24-19(29)11-18-26-27-21(28(18)2)31-12-20(30)25-17-9-8-14(22)10-15(17)23/h4-10H,3,11-12H2,1-2H3,(H,24,29)(H,25,30)InChIKey
OLMRBCBHKPRSQP-UHFFFAOYSA-NSynonyms
2(5((2((4BROMO2FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(2ETHYLPHENYL)ACETAMIDE
2(5((4BROMO2FLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(2ETHYLPHENYL)ACETAMIDE
2(5(2(4bromo2fluoroanilino)2oxoethyl)sulfanyl4methyl124triazol3yl)N(2ethylphenyl)acetamide
CCC1=CC=CC=C1NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=C(C=C(C=C3)Br)F
InChI=1SC21H21BrFN5O2Sc1313645716(13)2419(29)1118262721(28(18)2)311220(30)25179814(22)1015(17)23h410H31112H212H3(H2429)(H2530)
MFCD09960795
ZINC000013955912
ZINC13955912
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