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]-L-alaninamide
Catalog ID
STL549849
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)N[C@H](C(=O)N)C)Cl
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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 C19H21ClN2O6 MW 408.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN2O6/c1-8-5-10(22-9(2)18(21)25)6-13(23)19(8)17(24)14-11(26-3)7-12(27-4)15(20)16(14)28-19/h6-9,22H,5H2,1-4H3,(H2,21,25)/t8-,9+,19+/m1/s1InChIKey
URQIGPIXVKCXMU-MGOSUKFUSA-NSynonyms
(2~(S))2(((2~(S)5~(R))7chloro46dimethoxy5methyl33dioxospiro(1benzofuran24cyclohexene)1yl)amino)propanamide
(S)2(((1S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(benzofuran21cyclohex(3)en)4yl)amino)propanamide
127252885
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)N(C@H)(C(=O)N)C)Cl
InChI=1SC19H21ClN2O6c18510(229(2)18(21)25)613(23)19(8)17(24)1411(263)712(274)15(20)16(14)2819h6922H5H214H3(H22125)t89+19+m1s1
N~2~((2S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)4yl)Lalaninamide
N2((2S6R)7CHLORO46DIMETHOXY6METHYL23DIOXO3HSPIRO(1BENZOFURAN21CYCLOHEX(3)EN)4YL)LALANINAMIDE
ZINC000604405702
ZINC604405702
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