Vitas-M small molecule compound

ethyl 8-[(dichloroacetyl)amino]-2-methoxy-6a-methyl-5,6,6a,10,10a,10b,11,12-octahydro-4bH-naphtho[2',1':4,5]indeno[2,1-b]thiophene-7-carboxylate

Catalog ID
STL539862
SMILES CCOC(=O)c1c(NC(=O)C(Cl)Cl)sc2c1C1(C)CCC3C(C1C2)CCc1c3ccc(c1)OC

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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 C26H29Cl2NO4S MW 522.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29Cl2NO4S/c1-4-33-25(31)20-21-19(34-24(20)29-23(30)22(27)28)12-18-17-7-5-13-11-14(32-3)6-8-15(13)16(17)9-10-26(18,21)2/h6,8,11,16-18,22H,4-5,7,9-10,12H2,1-3H3,(H,29,30)
InChIKey
RLXPMEFDXSZYBY-UHFFFAOYSA-N
Synonyms
1574410-74-4
1574410744
71826376
ethyl10(22dichloroacetamido)4methoxy8amethyl26b788a1212a12boctahydro1Hnaphtho(2145)indeno(21b)thiophene9carboxylate
ethyl6((22dichloroacetyl)amino)16methoxy9methyl5thiapentacyclo(10800^(29)0^(48)0^(1318))icosa4(8)613(18)1416pentaene7carboxylate
ethyl8((dichloroacetyl)amino)2methoxy6amethyl566a1010a10b1112octahydro4bHnaphtho(2145)indeno(21b)thiophene7carboxylate
InChI=1SC26H29Cl2NO4Sc143325(31)202119(3424(20)2923(30)22(27)28)12181775131114(323)6815(13)16(17)91026(1821)2h6811161822H45791012H213H3(H2930)
MFCD28051411
ZINC000108238168
ZINC000252512506

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.