Vitas-M small molecule compound

methyl 2-({[3-(4-bromophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}amino)-4-chlorobenzoate

Catalog ID
STL030826
SMILES COC(=O)c1ccc(cc1NC(=O)Cn1nc(ccc1=O)c1ccc(cc1)Br)Cl

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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 C20H15BrClN3O4 MW 476.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrClN3O4/c1-29-20(28)15-7-6-14(22)10-17(15)23-18(26)11-25-19(27)9-8-16(24-25)12-2-4-13(21)5-3-12/h2-10H,11H2,1H3,(H,23,26)
InChIKey
RPVLGJIACGQURR-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br
InChI=1SC20H15BrClN3O4c12920(28)157614(22)1017(15)2318(26)112519(27)9816(2425)122413(21)5312h210H11H21H3(H2326)
methyl2(((3(4bromophenyl)6oxopyridazin1(6H)yl)acetyl)amino)4chlorobenzoate
methyl2((2(3(4bromophenyl)6oxopyridazin1yl)acetyl)amino)4chlorobenzoate
MFCD18190955
ZINC000067695100
ZINC67695100

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Available files

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