Vitas-M small molecule compound
2-(3-{[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]amino}phenyl)acetamide
Catalog ID
STL551464
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)Nc1cccc(c1)CC(=O)N)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 C24H23ClN2O6 MW 470.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN2O6/c1-12-7-15(27-14-6-4-5-13(8-14)9-19(26)29)10-18(28)24(12)23(30)20-16(31-2)11-17(32-3)21(25)22(20)33-24/h4-6,8,10-12,27H,7,9H2,1-3H3,(H2,26,29)/t12-,24+/m1/s1InChIKey
HLMOWKPTJFSTLW-YYUOZPCZSA-NSynonyms
125429639
2(3(((1S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(benzofuran21cyclohex(3)en)4yl)amino)phenyl)acetamide
2(3(((2~(S)5~(R))7chloro46dimethoxy5methyl33dioxospiro(1benzofuran24cyclohexene)1yl)amino)phenyl)acetamide
2(3(((2S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)4yl)amino)phenyl)acetamide
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)Nc1cccc(c1)CC(=O)N)Cl
InChI=1SC24H23ClN2O6c112715(271464513(814)919(26)29)1018(28)24(12)23(30)2016(312)1117(323)21(25)22(20)3324h468101227H79H213H3(H22629)t1224+m1s1
ZINC000524731026
ZINC524731026
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