Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-2-[3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenoxy]acetamide
Catalog ID
STL506548
SMILES O=C(Nc1ccc(c(c1)Cl)C)COc1cccc(c1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(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 C32H34ClNO5 MW 548.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34ClNO5/c1-18-9-10-20(12-22(18)33)34-27(37)17-38-21-8-6-7-19(11-21)28-29-23(35)13-31(2,3)15-25(29)39-26-16-32(4,5)14-24(36)30(26)28/h6-12,28H,13-17H2,1-5H3,(H,34,37)InChIKey
BWNCOQURCKIAQJ-UHFFFAOYSA-NSynonyms
~(N)(3chloro4methylphenyl)2(3(3366tetramethyl18dioxo4579tetrahydro2~(H)xanthen9yl)phenoxy)acetamide
1006714
InChI=1SC32H34ClNO5c11891020(1222(18)33)3427(37)17382186719(1121)282923(35)1331(23)1525(29)39261632(45)1424(36)30(26)28h61228H1317H215H3(H3437)
MFCD04090072
N(3chloro4methylphenyl)2(3(3366tetramethyl18dioxo23456789octahydro1Hxanthen9yl)phenoxy)acetamide
ZINC000000665644
ZINC665644
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