Vitas-M small molecule compound

2-[(2R,6'R)-7-chloro-4,6-dimethoxy-2'-(4-methoxyphenyl)-6'-methyl-3,4'-dioxo-6',7'-dihydro-3H,4'H-2,5'-spirobi[[1]benzofuran]-3'-yl]-N-(pyridin-2-ylmethyl)acetamide

Catalog ID
STL562089
SMILES COc1ccc(cc1)c1oc2c(c1CC(=O)NCc1ccccn1)C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC

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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 C33H29ClN2O8 MW 617.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29ClN2O8/c1-17-13-23-26(31(38)33(17)32(39)27-22(41-3)15-24(42-4)28(34)30(27)44-33)21(14-25(37)36-16-19-7-5-6-12-35-19)29(43-23)18-8-10-20(40-2)11-9-18/h5-12,15,17H,13-14,16H2,1-4H3,(H,36,37)/t17-,33+/m1/s1
InChIKey
YDSWEGBXRUXNQI-JSRFKQPZSA-N
Synonyms

145705440
2((2R6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi((1)benzofuran)3yl)N(pyridin2ylmethyl)acetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi(benzofuran)3yl)N(pyridin2ylmethyl)acetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxospiro(1benzofuran2567dihydro1benzofuran)3yl)N(pyridin2ylmethyl)acetamide
COc1ccc(cc1)c1oc2c(c1CC(=O)NCc1ccccn1)C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
InChI=1SC33H29ClN2O8c117132326(31(38)33(17)32(39)2722(413)1524(424)28(34)30(27)4433)21(1425(37)361619756123519)29(4323)1881020(402)11918h5121517H131416H214H3(H3637)t1733+m1s1
MFCD32651143
ZINC001848443518

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Available files

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