Vitas-M small molecule compound
2-({6-[2-(acetylamino)-5-methylphenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)-N-(2-chlorophenyl)butanamide
Catalog ID
STL570993
SMILES CCC(C(=O)Nc1ccccc1Cl)Sc1[nH]nc(c(=O)n1)c1cc(C)ccc1NC(=O)C
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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 C22H22ClN5O3S MW 471.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O3S/c1-4-18(20(30)25-17-8-6-5-7-15(17)23)32-22-26-21(31)19(27-28-22)14-11-12(2)9-10-16(14)24-13(3)29/h5-11,18H,4H2,1-3H3,(H,24,29)(H,25,30)(H,26,28,31)InChIKey
MDWWELUSCKJMOY-UHFFFAOYSA-NSynonyms
145916199
2((6(2(acetylamino)5methylphenyl)5oxo25dihydro124triazin3yl)sulfanyl)N(2chlorophenyl)butanamide
2((6(2acetamido5methylphenyl)5oxo4H124triazin3yl)sulfanyl)N(2chlorophenyl)butanamide
InChI=1SC22H22ClN5O3Sc1418(20(30)2517865715(17)23)32222621(31)19(272822)141112(2)91016(14)2413(3)29h51118H4H213H3(H2429)(H2530)(H262831)
MFCD32650088
ZINC001848442315
ZINC001848442316
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