Vitas-M small molecule compound
2-({6-[2-(acetylamino)-5-methylphenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)propanamide
Catalog ID
STL570995
SMILES CC(=O)Nc1ccc(cc1c1n[nH]c(nc1=O)SC(C(=O)Nc1cccc(c1C)Cl)C)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/c1-11-8-9-18(24-14(4)29)15(10-11)19-21(31)26-22(28-27-19)32-13(3)20(30)25-17-7-5-6-16(23)12(17)2/h5-10,13H,1-4H3,(H,24,29)(H,25,30)(H,26,28,31)InChIKey
QSMQCZWPGHGQDR-UHFFFAOYSA-NSynonyms
135969634
2((6(2(acetylamino)5methylphenyl)5oxo25dihydro124triazin3yl)sulfanyl)N(3chloro2methylphenyl)propanamide
2((6(2(ACETYLAMINO)5METHYLPHENYL)5OXO45DIHYDRO124TRIAZIN3YL)THIO)N(3CHLORO2METHYLPHENYL)PROPANAMIDE
2((6(2acetamido5methylphenyl)5oxo4H124triazin3yl)sulfanyl)N(3chloro2methylphenyl)propanamide
InChI=1SC22H22ClN5O3Sc1118918(2414(4)29)15(1011)1921(31)2622(282719)3213(3)20(30)251775616(23)12(17)2h51013H14H3(H2429)(H2530)(H262831)
MFCD32650090
ZINC000021882666
ZINC000021882667
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