Vitas-M small molecule compound

N-(bicyclo[2.2.1]hept-5-en-2-ylmethyl)-2-[3-(2-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetamide

Catalog ID
STL317177
SMILES COc1ccccc1c1ccc(=O)n(n1)CC(=O)NCC1CC2CC1C=C2

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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 C21H23N3O3 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3/c1-27-19-5-3-2-4-17(19)18-8-9-21(26)24(23-18)13-20(25)22-12-16-11-14-6-7-15(16)10-14/h2-9,14-16H,10-13H2,1H3,(H,22,25)
InChIKey
LRWTYMVGOKIRTD-UHFFFAOYSA-N
Synonyms
1435981-55-7
1435981557
COC1=CC=CC=C1C2=NN(C(=O)C=C2)CC(=O)NCC3CC4CC3C=C4
InChI=1SC21H23N3O3c12719532417(19)188921(26)24(2318)1320(25)22121611146715(16)1014h291416H1013H21H3(H2225)
MFCD23139722
N(5bicyclo(221)hept2enylmethyl)2(3(2methoxyphenyl)6oxopyridazin1yl)acetamide
N(bicyclo(221)hept5en2ylmethyl)2(3(2methoxyphenyl)6oxopyridazin1(6H)yl)acetamide
ZINC000101371532
ZINC000101371534

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.