Vitas-M small molecule compound
(2R,3'E,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-3'-{1-[(2-sulfanylethyl)amino]ethylidene}-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trione
Catalog ID
STL561886
SMILES SCCN/C(=C/1\C(=O)C[C@H]([C@@]2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)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 C20H22ClNO6S MW 439.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO6S/c1-9-7-11(23)14(10(2)22-5-6-29)18(24)20(9)19(25)15-12(26-3)8-13(27-4)16(21)17(15)28-20/h8-9,22,29H,5-7H2,1-4H3/b14-10+/t9-,20+/m1/s1InChIKey
DRCVFSKWCTWSQD-KFLPGBLVSA-NSynonyms
(1R6RE)7chloro3(1((2mercaptoethyl)amino)ethylidene)46dimethoxy6methyl3Hspiro(benzofuran21cyclohexane)234trione
(2R3E6R)7chloro46dimethoxy6methyl3(1((2sulfanylethyl)amino)ethylidene)2H3H4Hspiro(1benzofuran21cyclohexane)234trione
MFCD32650946
SCCNC(=C1C(=O)C(C@H)((C@@)2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)C
ZINC001848442659
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