Vitas-M small molecule compound
N-{2-[5-({2-[(3,4-difluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide
Catalog ID
STK297403
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1CCNC(=O)c1ccccc1F
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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 C21H20F3N5O2S MW 463.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O2S/c1-2-29-18(9-10-25-20(31)14-5-3-4-6-15(14)22)27-28-21(29)32-12-19(30)26-13-7-8-16(23)17(24)11-13/h3-8,11H,2,9-10,12H2,1H3,(H,25,31)(H,26,30)InChIKey
WVLQOCFXBIHUCU-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)F)CCNC(=O)C3=CC=CC=C3F
InChI=1SC21H20F3N5O2Sc122918(9102520(31)14534615(14)22)272821(29)321219(30)26137816(23)17(24)1113h3811H291012H21H3(H2531)(H2630)
MFCD09960974
N(2(5((2((34difluorophenyl)amino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)ethyl)2fluorobenzamide
N(2(5((34DIFLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(2(5(2(34difluoroanilino)2oxoethyl)sulfanyl4ethyl124triazol3yl)ethyl)2fluorobenzamide
ZINC000009505508
ZINC09505508
ZINC9505508
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