Vitas-M small molecule compound
2-[(2R,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-3,4'-dioxo-2'-phenyl-6',7'-dihydro-3H,4'H-2,5'-spirobi[[1]benzofuran]-3'-yl]-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide
Catalog ID
STL579738
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)Cc2c(C1=O)c(CC(=O)NCc1csc(n1)c1ccccc1)c(o2)c1ccccc1)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 C36H29ClN2O7S MW 669.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29ClN2O7S/c1-19-14-25-28(33(41)36(19)34(42)29-24(43-2)16-26(44-3)30(37)32(29)46-36)23(31(45-25)20-10-6-4-7-11-20)15-27(40)38-17-22-18-47-35(39-22)21-12-8-5-9-13-21/h4-13,16,18-19H,14-15,17H2,1-3H3,(H,38,40)/t19-,36+/m1/s1InChIKey
ZQJIFEJPHRKCMU-TVKFYGHBSA-NSynonyms
2((2R6R)7chloro46dimethoxy6methyl34dioxo2phenyl67dihydro3H4H25spirobi((1)benzofuran)3yl)N((2phenyl13thiazol4yl)methyl)acetamide
2((2S6R)7chloro46dimethoxy6methyl34dioxo2phenyl67dihydro3H4H25spirobi(benzofuran)3yl)N((2phenylthiazol4yl)methyl)acetamide
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)Cc2c(C1=O)c(CC(=O)NCc1csc(n1)c1ccccc1)c(o2)c1ccccc1)Cl
InChI=1SC36H29ClN2O7Sc119142528(33(41)36(19)34(42)2924(432)1626(443)30(37)32(29)4636)23(31(4525)20106471120)1527(40)381722184735(3922)21128591321h413161819H141517H213H3(H3840)t1936+m1s1
MFCD33398066
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