Vitas-M small molecule compound
4-(10-benzyl-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)-2-ethoxy-6-iodophenyl 4-methylbenzenesulfonate
Catalog ID
STL553911
SMILES CCOc1cc(cc(c1OS(=O)(=O)c1ccc(cc1)C)I)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)Cc1ccccc1
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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 C39H42INO6S MW 779.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H42INO6S/c1-7-46-33-18-26(17-28(40)37(33)47-48(44,45)27-15-13-24(2)14-16-27)34-35-29(19-38(3,4)21-31(35)42)41(23-25-11-9-8-10-12-25)30-20-39(5,6)22-32(43)36(30)34/h8-18,34H,7,19-23H2,1-6H3InChIKey
SEWCFBKAJDVRLE-UHFFFAOYSA-NSynonyms
(4(10benzyl3366tetramethyl18dioxo4579tetrahydro2~(H)acridin9yl)2ethoxy6iodophenyl)4methylbenzenesulfonate
3927160
4(10benzyl3366tetramethyl18dioxo12345678910decahydroacridin9yl)2ethoxy6iodophenyl4methylbenzenesulfonate
InChI=1SC39H42INO6Sc1746331826(1728(40)37(33)4748(4445)27151324(2)141627)343529(1938(34)2131(35)42)41(23251198101225)302039(56)2232(43)36(30)34h81834H71923H216H3
MFCD03271869
ZINC000008439084
ZINC8439084
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