Vitas-M small molecule compound

ethyl 3-{[(3-bromotricyclo[3.3.1.1~3,7~]dec-1-yl)carbonyl]amino}-5-fluoro-1H-indole-2-carboxylate

Catalog ID
STL333658
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)C13CC4CC(C1)CC(C3)(C4)Br)cc(cc2)F

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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 C22H24BrFN2O3 MW 463.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrFN2O3/c1-2-29-19(27)18-17(15-6-14(24)3-4-16(15)25-18)26-20(28)21-7-12-5-13(8-21)10-22(23,9-12)11-21/h3-4,6,12-13,25H,2,5,7-11H2,1H3,(H,26,28)
InChIKey
DLVRZMCNJPGLGY-UHFFFAOYSA-N
Synonyms
956370-53-9
956370539
CCOC(=O)c1(nH)c2c(c1NC(=O)C13CC4CC(C1)CC(C3)(C4)Br)cc(cc2)F
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)C34CC5CC(C3)CC(C5)(C4)Br
ethyl3(((3bromotricyclo(3311~37~)dec1yl)carbonyl)amino)5fluoro1Hindole2carboxylate
ethyl3((1r3s5R7S)3bromoadamantane1carboxamido)5fluoro1Hindole2carboxylate
ETHYL3((3BROMOADAMANTANE1CARBONYL)AMINO)5FLUORO1HINDOLE2CARBOXYLATE
InChI=1SC22H24BrFN2O3c122919(27)1817(15614(24)3416(15)2518)2620(28)21712513(821)1022(23912)1121h346121325H25711H21H3(H2628)
ZINC000100839582

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Available files

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