Vitas-M small molecule compound
1-tert-butyl-3-{[2-(3-chloro-4-methylphenyl)-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl]methyl}urea
Catalog ID
STL438482
SMILES O=C(NC(C)(C)C)NCC12C=CC(O1)C1C2C(=O)N(C1=O)c1ccc(c(c1)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 C21H24ClN3O4 MW 417.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O4/c1-11-5-6-12(9-13(11)22)25-17(26)15-14-7-8-21(29-14,16(15)18(25)27)10-23-19(28)24-20(2,3)4/h5-9,14-16H,10H2,1-4H3,(H2,23,24,28)InChIKey
VAMPMQGOGIZPGR-UHFFFAOYSA-NSynonyms
1tertbutyl3((2(3chloro4methylphenyl)13dioxo1233a77ahexahydro4H47epoxyisoindol4yl)methyl)urea
1tertbutyl3((2(3chloro4methylphenyl)13dioxo77adihydro3aHoctahydro1H47epoxyisoindol4yl)methyl)urea
CC1=C(C=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)(O4)CNC(=O)NC(C)(C)C)Cl
InChI=1SC21H24ClN3O4c1115612(913(11)22)2517(26)15147821(291416(15)18(25)27)102319(28)2420(23)4h591416H10H214H3(H2232428)
MFCD07397443
ZINC000103134765
ZINC000245230591
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