Vitas-M small molecule compound
4-chloro-N-{2-[5-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK299446
SMILES O=C(Nc1ccccc1F)CSc1nnc(n1C)CCNC(=O)c1ccc(cc1)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 C20H19ClFN5O2S MW 447.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClFN5O2S/c1-27-17(10-11-23-19(29)13-6-8-14(21)9-7-13)25-26-20(27)30-12-18(28)24-16-5-3-2-4-15(16)22/h2-9H,10-12H2,1H3,(H,23,29)(H,24,28)InChIKey
POIJXNQIKMENSG-UHFFFAOYSA-NSynonyms
4chloroN(2(5((2((2fluorophenyl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)ethyl)benzamide
4CHLORON(2(5((2FLUOROPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ETHYL)BENZAMIDE
4chloroN(2(5(2(2fluoroanilino)2oxoethyl)sulfanyl4methyl124triazol3yl)ethyl)benzamide
CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)CCNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H19ClFN5O2Sc12717(10112319(29)136814(21)9713)252620(27)301218(28)2416532415(16)22h29H1012H21H3(H2329)(H2428)
MFCD05112071
ZINC000013957481
ZINC13957481
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