Vitas-M small molecule compound
2-({6-[2-(acetylamino)-3-methylphenyl]-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)-N-(4-chlorophenyl)propanamide
Catalog ID
STL571514
SMILES CC(=O)Nc1c(C)cccc1c1n[nH]c(nc1=O)SC(C(=O)Nc1ccc(cc1)Cl)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 C21H20ClN5O3S MW 457.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O3S/c1-11-5-4-6-16(17(11)23-13(3)28)18-20(30)25-21(27-26-18)31-12(2)19(29)24-15-9-7-14(22)8-10-15/h4-10,12H,1-3H3,(H,23,28)(H,24,29)(H,25,27,30)InChIKey
XPKNXRNPRMTHRS-UHFFFAOYSA-NSynonyms
135969831
2((6(2(acetylamino)3methylphenyl)5oxo25dihydro124triazin3yl)sulfanyl)N(4chlorophenyl)propanamide
2((6(2(ACETYLAMINO)3METHYLPHENYL)5OXO45DIHYDRO124TRIAZIN3YL)THIO)N(4CHLOROPHENYL)PROPANAMIDE
2((6(2acetamido3methylphenyl)5oxo4H124triazin3yl)sulfanyl)N(4chlorophenyl)propanamide
InChI=1SC21H20ClN5O3Sc11154616(17(11)2313(3)28)1820(30)2521(272618)3112(2)19(29)24159714(22)81015h41012H13H3(H2328)(H2429)(H252730)
MFCD14859535
ZINC000044803202
ZINC000044803205
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