Vitas-M small molecule compound

N-[3-(1,3-benzodioxol-5-yl)-4-oxo-4H-chromen-2-yl]-4-tert-butylbenzamide

Catalog ID
STK714702
SMILES O=C(c1ccc(cc1)C(C)(C)C)Nc1oc2ccccc2c(=O)c1c1ccc2c(c1)OCO2

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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 C27H23NO5 MW 441.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO5/c1-27(2,3)18-11-8-16(9-12-18)25(30)28-26-23(17-10-13-21-22(14-17)32-15-31-21)24(29)19-6-4-5-7-20(19)33-26/h4-14H,15H2,1-3H3,(H,28,30)
InChIKey
NMQFFFWXMMWFPO-UHFFFAOYSA-N
Synonyms
883954-12-9
883954129
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C(=O)C3=CC=CC=C3O2)C4=CC5=C(C=C4)OCO5
InChI=1SC27H23NO5c127(23)1811816(91218)25(30)282623(1710132122(1417)32153121)24(29)19645720(19)3326h414H15H213H3(H2830)
MFCD06780906
N(3(13benzodioxol5yl)4oxo4Hchromen2yl)4tertbutylbenzamide
N(3(13BENZODIOXOL5YL)4OXOCHROMEN2YL)4TERTBUTYLBENZAMIDE
N(3(benzo(d)(13)dioxol5yl)4oxo4Hchromen2yl)4(tertbutyl)benzamide
ZINC000009327655
ZINC09327655
ZINC9327655

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Available files

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