Vitas-M small molecule compound
N~2~-[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]-N-methyl-L-alaninamide
Catalog ID
STL550739
SMILES CNC(=O)[C@@H](NC1=CC(=O)[C@]2([C@@H](C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)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 C20H23ClN2O6 MW 422.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O6/c1-9-6-11(23-10(2)19(26)22-3)7-14(24)20(9)18(25)15-12(27-4)8-13(28-5)16(21)17(15)29-20/h7-10,23H,6H2,1-5H3,(H,22,26)/t9-,10+,20+/m1/s1InChIKey
ARTHRGRJHFKZCT-ARNPGYACSA-NSynonyms
(2~(S))2(((2~(S)5~(R))7chloro46dimethoxy5methyl33dioxospiro(1benzofuran24cyclohexene)1yl)amino)~(N)methylpropanamide
(S)2(((1S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(benzofuran21cyclohex(3)en)4yl)amino)Nmethylpropanamide
127253557
CNC(=O)(C@@H)(NC1=CC(=O)(C@)2((C@@H)(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C
InChI=1SC20H23ClN2O6c19611(2310(2)19(26)223)714(24)20(9)18(25)1512(274)813(285)16(21)17(15)2920h71023H6H215H3(H2226)t910+20+m1s1
N~2~((2S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)4yl)NmethylLalaninamide
N2((2S6R)7CHLORO46DIMETHOXY6METHYL23DIOXO3HSPIRO(1BENZOFURAN21CYCLOHEX(3)EN)4YL)NMETHYLLALANINAMIDE
ZINC000604403860
ZINC604403860
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