Vitas-M small molecule compound

[3-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl](morpholin-4-yl)methanone

Catalog ID
STL170961
SMILES Brc1nc(nn1C12CC3CC(C1)CC(C2)(C3)C(=O)N1CCOCC1)[N+](=O)[O-]

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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 C17H22BrN5O4 MW 440.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22BrN5O4/c18-14-19-15(23(25)26)20-22(14)17-8-11-5-12(9-17)7-16(6-11,10-17)13(24)21-1-3-27-4-2-21/h11-12H,1-10H2
InChIKey
NFJHTYWUIAQLSX-UHFFFAOYSA-N
Synonyms
362620-87-9
(3(5BROMO3NITRO124TRIAZOL1YL)1ADAMANTYL)MORPHOLIN4YLMETHANONE
(3(5bromo3nitro1H124triazol1yl)tricyclo(3311~37~)dec1yl)(morpholin4yl)methanone
362620879
Brc1nc(nn1C12CC3CC(C1)CC(C2)(C3)C(=O)N1CCOCC1)(N+)(=O)(O)
C1COCCN1C(=O)C23CC4CC(C2)CC(C4)(C3)N5C(=NC(=N5)(N+)(=O)(O))Br
InChI=1SC17H22BrN5O4c18141915(23(25)26)2022(14)17811512(917)716(6111017)13(24)2113274221h1112H110H2
ZINC000013881971

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Available files

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