Vitas-M small molecule compound
2-[4-chloro-2-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]-N-(3-chloro-4-methylphenyl)acetamide
Catalog ID
STL484490
SMILES O=C(Nc1ccc(c(c1)Cl)C)COc1ccc(cc1C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)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 C28H25Cl2NO5 MW 526.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25Cl2NO5/c1-15-8-10-17(13-19(15)30)31-25(34)14-35-22-11-9-16(29)12-18(22)26-27-20(32)4-2-6-23(27)36-24-7-3-5-21(33)28(24)26/h8-13,26H,2-7,14H2,1H3,(H,31,34)InChIKey
REDVCCOIXISRDV-UHFFFAOYSA-NSynonyms
2(4chloro2(18dioxo23456789octahydro1Hxanthen9yl)phenoxy)N(3chloro4methylphenyl)acetamide
2(4chloro2(18dioxo345679hexahydro2Hxanthen9yl)phenoxy)N(3chloro4methylphenyl)acetamide
CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Cl)C3C4=C(CCCC4=O)OC5=C3C(=O)CCC5)Cl
InChI=1SC28H25Cl2NO5c11581017(1319(15)30)3125(34)14352211916(29)1218(22)262720(32)42623(27)362473521(33)28(24)26h81326H2714H21H3(H3134)
MFCD04090088
ZINC000000665743
ZINC00665743
ZINC665743
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