Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[12-oxo-1-(prop-2-en-1-yl)-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl]oxy}acetamide
Catalog ID
STL519326
SMILES C=CCc1c(OCC(=O)Nc2ccc3c(c2)OCO3)ccc2c1c(=O)n1c(n2)CCCCC1
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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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c1-2-6-17-19(31-14-23(29)26-16-8-10-20-21(13-16)33-15-32-20)11-9-18-24(17)25(30)28-12-5-3-4-7-22(28)27-18/h2,8-11,13H,1,3-7,12,14-15H2,(H,26,29)InChIKey
IGNJTNJABAAKBU-UHFFFAOYSA-NSynonyms
1071915-02-0~(N)(13benzodioxol5yl)2((12oxo1prop2enyl78910tetrahydro6~(H)azepino(21b)quinazolin2yl)oxy)acetamide
1071915020
2((1allyl12oxo67891012hexahydroazepino(21b)quinazolin2yl)oxy)N(benzo(d)(13)dioxol5yl)acetamide
29147298
InChI=1SC25H25N3O5c1261719(311423(29)26168102021(1316)33153220)1191824(17)25(30)2812534722(28)2718h281113H137121415H2(H2629)
MFCD12029456
N(13benzodioxol5yl)2((12oxo1(prop2en1yl)67891012hexahydroazepino(21b)quinazolin2yl)oxy)acetamide
ZINC000020761025
ZINC20761025
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