Vitas-M small molecule compound

N-(bicyclo[2.2.1]hept-5-en-2-ylmethyl)-2-[3-(4-bromophenyl)-6-oxopyridazin-1(6H)-yl]acetamide

Catalog ID
STL158876
SMILES O=C(Cn1nc(ccc1=O)c1ccc(cc1)Br)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 C20H20BrN3O2 MW 414.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrN3O2/c21-17-5-3-14(4-6-17)18-7-8-20(26)24(23-18)12-19(25)22-11-16-10-13-1-2-15(16)9-13/h1-8,13,15-16H,9-12H2,(H,22,25)
InChIKey
MICFIKJFOXBJPF-UHFFFAOYSA-N
Synonyms
1246071-59-9
1246071599
C1C2CC(C1C=C2)CNC(=O)CN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Br
InChI=1SC20H20BrN3O2c21175314(4617)187820(26)24(2318)1219(25)22111610131215(16)913h18131516H912H2(H2225)
MFCD18065553
N(5bicyclo(221)hept2enylmethyl)2(3(4bromophenyl)6oxopyridazin1yl)acetamide
N(bicyclo(221)hept5en2ylmethyl)2(3(4bromophenyl)6oxopyridazin1(6H)yl)acetamide
ZINC000101675060
ZINC000101675063

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Available files

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