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-(2-methoxyphenyl)glycinamide

Catalog ID
STL549665
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)NCC(=O)Nc1ccccc1OC)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 C25H25ClN2O7 MW 500.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O7/c1-13-9-14(27-12-20(30)28-15-7-5-6-8-16(15)32-2)10-19(29)25(13)24(31)21-17(33-3)11-18(34-4)22(26)23(21)35-25/h5-8,10-11,13,27H,9,12H2,1-4H3,(H,28,30)/t13-,25+/m1/s1
InChIKey
IXSDQMODFROUSR-SHZVTRLKSA-N
Synonyms

127253365
2(((1S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(benzofuran21cyclohex(3)en)4yl)amino)N(2methoxyphenyl)acetamide
2(((2~(S)5~(R))7chloro46dimethoxy5methyl33dioxospiro(1benzofuran24cyclohexene)1yl)amino)~(N)(2methoxyphenyl)acetamide
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)NCC(=O)Nc1ccccc1OC)Cl
InChI=1SC25H25ClN2O7c113914(271220(30)2815756816(15)322)1019(29)25(13)24(31)2117(333)1118(344)22(26)23(21)3525h5810111327H912H214H3(H2830)t1325+m1s1
N~2~((2S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)4yl)N(2methoxyphenyl)glycinamide
N2((2S6R)7CHLORO46DIMETHOXY6METHYL23DIOXO3HSPIRO(1BENZOFURAN21CYCLOHEX(3)EN)4YL)N(2METHOXYPHENYL)GLYCINAMIDE
ZINC000604404905
ZINC604404905

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Available files

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