Vitas-M small molecule compound
(3E)-7-bromo-3-[2-(3-methoxyphenyl)-2-oxoethylidene]-3,4-dihydropyrido[2,3-b]pyrazin-2(1H)-one
Catalog ID
STL442882
SMILES COc1cccc(c1)C(=O)/C=c\1/[nH]c2ncc(cc2[nH]c1=O)Br
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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 C16H12BrN3O3 MW 374.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrN3O3/c1-23-11-4-2-3-9(5-11)14(21)7-13-16(22)20-12-6-10(17)8-18-15(12)19-13/h2-8H,1H3,(H,18,19)(H,20,22)/b13-7+InChIKey
DZIMMASWRVOEIT-NTUHNPAUSA-NSynonyms
(3E)7bromo3(2(3methoxyphenyl)2oxoethylidene)14dihydropyrido(23b)pyrazin2one
(3E)7bromo3(2(3methoxyphenyl)2oxoethylidene)34dihydropyrido(23b)pyrazin2(1H)one
COC1=CC=CC(=C1)C(=O)C=C2C(=O)NC3=CC(=CN=C3N2)Br
COc1cccc(c1)C(=O)C=c1(nH)c2ncc(cc2(nH)c1=O)Br
InChI=1SC16H12BrN3O3c123114239(511)14(21)71316(22)2012610(17)81815(12)1913h28H1H3(H1819)(H2022)b137+
MFCD14741878
ZINC000085958847
ZINC85958847
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