Vitas-M small molecule compound

2-{[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}-N-[(2S)-1-hydroxypropan-2-yl]acetamide

Catalog ID
STK624144
SMILES OC[C@@H](NC(=O)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O)C

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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 C21H19NO7 MW 397.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO7/c1-12(9-23)22-20(24)10-26-14-3-4-15-17(8-14)29-19(21(15)25)7-13-2-5-16-18(6-13)28-11-27-16/h2-8,12,23H,9-11H2,1H3,(H,22,24)/b19-7-/t12-/m0/s1
InChIKey
MLNZBQZSKVOTPJ-IMMGQNJASA-N
Synonyms
1013816-90-4
(SZ)2((2(benzo(d)(13)dioxol5ylmethylene)3oxo23dihydrobenzofuran6yl)oxy)N(1hydroxypropan2yl)acetamide
1013816904
2(((2Z)2(13benzodioxol5ylmethylidene)3oxo1benzofuran6yl)oxy)N((2S)1hydroxypropan2yl)acetamide
2(((2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6yl)oxy)N((2S)1hydroxypropan2yl)acetamide
CC(CO)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC4=C(C=C3)OCO4)O2
InChI=1SC21H19NO7c112(923)2220(24)102614341517(814)2919(21(15)25)713251618(613)28112716h281223H911H21H3(H2224)b197t12m0s1
MFCD09858198
OC(C@@H)(NC(=O)COc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O)C
ZINC000013733184
ZINC13733184

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Available files

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