Vitas-M small molecule compound

5-[2-(4-methoxyphenyl)-2-oxoethyl]-1-methyl-1H-[1,2,3]triazolo[4,5-c]pyridin-5-ium

Catalog ID
STL326185
SMILES COc1ccc(cc1)C(=O)C[n+]1ccc2c(c1)nnn2C

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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 C15H15N4O2 MW 283.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N4O2/c1-18-14-7-8-19(9-13(14)16-17-18)10-15(20)11-3-5-12(21-2)6-4-11/h3-9H,10H2,1-2H3/q+1
InChIKey
LLPFVGGZAVPOGC-UHFFFAOYSA-N
Synonyms

1(4METHOXYPHENYL)2(1METHYL(123TRIAZOLO(45C)PYRIDIN5YL))ETHAN1ONE
1(4METHOXYPHENYL)2(1METHYLTRIAZOLO(45C)PYRIDIN5IUM5YL)ETHANONE
5(2(4methoxyphenyl)2oxoethyl)1methyl1H(123)triazolo(45c)pyridin5ium
5(2(4methoxyphenyl)2oxoethyl)1methyl1H(123)triazolo(45c)pyridin5iumbromide
CN1C2=C(C=(N+)(C=C2)CC(=O)C3=CC=C(C=C3)OC)N=N1
COc1ccc(cc1)C(=O)C(n+)1ccc2c(c1)nnn2C
COc1ccc(cc1)C(=O)C(n+)1ccc2c(c1)nnn2C(Br)
InChI=1SC15H15N4O2c118147819(913(14)161718)1015(20)113512(212)6411h39H10H212H3q+1
MFCD00986481
ZINC000004140939
ZINC04140939
ZINC4140939

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Available files

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