Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-2-[2,6-dichloro-4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetamide
Catalog ID
STL558435
SMILES O=C(Nc1ccc(c(c1)Cl)C)COc1c(Cl)cc(cc1Cl)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2
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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 C28H24Cl3NO5 MW 560.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24Cl3NO5/c1-14-8-9-16(12-17(14)29)32-24(35)13-36-28-18(30)10-15(11-19(28)31)25-26-20(33)4-2-6-22(26)37-23-7-3-5-21(34)27(23)25/h8-12,25H,2-7,13H2,1H3,(H,32,35)InChIKey
WQEKHIDEMYLZMU-UHFFFAOYSA-NSynonyms
~(N)(3chloro4methylphenyl)2(26dichloro4(18dioxo345679hexahydro2~(H)xanthen9yl)phenoxy)acetamide
1006859
InChI=1SC28H24Cl3NO5c1148916(1217(14)29)3224(35)13362818(30)1015(1119(28)31)252620(33)42622(26)372373521(34)27(23)25h81225H2713H21H3(H3235)
MFCD04150611
N(3chloro4methylphenyl)2(26dichloro4(18dioxo23456789octahydro1Hxanthen9yl)phenoxy)acetamide
ZINC000000665834
ZINC00665834
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