Vitas-M small molecule compound
3,4-dichloro-N-{2-[4-ethyl-5-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK187039
SMILES CCn1c(CCNC(=O)c2ccc(c(c2)Cl)Cl)nnc1SCC(=O)Nc1ccccc1F
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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 C21H20Cl2FN5O2S MW 496.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20Cl2FN5O2S/c1-2-29-18(9-10-25-20(31)13-7-8-14(22)15(23)11-13)27-28-21(29)32-12-19(30)26-17-6-4-3-5-16(17)24/h3-8,11H,2,9-10,12H2,1H3,(H,25,31)(H,26,30)InChIKey
CPGGUYUHGUHGAC-UHFFFAOYSA-NSynonyms
34DICHLORON(2(4ETHYL5((2((2FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(2(4ETHYL5(2(2FLUOROANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H20Cl2FN5O2Sc122918(9102520(31)137814(22)15(23)1113)272821(29)321219(30)2617643516(17)24h3811H291012H21H3(H2531)(H2630)
MFCD06628695
ZINC000002881888
ZINC02881888
ZINC2881888
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