Vitas-M small molecule compound
3,4-dichloro-N-{2-[5-({2-[(2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK219002
SMILES O=C(Nc1ccccc1F)CSc1nnc(n1C)CCNC(=O)c1ccc(c(c1)Cl)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 C20H18Cl2FN5O2S MW 482.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2FN5O2S/c1-28-17(8-9-24-19(30)12-6-7-13(21)14(22)10-12)26-27-20(28)31-11-18(29)25-16-5-3-2-4-15(16)23/h2-7,10H,8-9,11H2,1H3,(H,24,30)(H,25,29)InChIKey
MCCWSPLHDVSFOS-UHFFFAOYSA-NSynonyms
34DICHLORON(2(5((2((2FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(2(5(2(2FLUOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC20H18Cl2FN5O2Sc12817(892419(30)126713(21)14(22)1012)262720(28)311118(29)2516532415(16)23h2710H8911H21H3(H2430)(H2529)
MFCD06628491
ZINC000001067045
ZINC01067045
ZINC1067045
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