Vitas-M small molecule compound

4-[2-(4-methoxyphenyl)-2-oxoethyl]-1-(2-oxo-2-phenylethyl)-1H-1,2,4-triazol-4-ium

Catalog ID
STK043223
SMILES COc1ccc(cc1)C(=O)C[n+]1cnn(c1)CC(=O)c1ccccc1

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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 C19H18N3O3 MW 336.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N3O3/c1-25-17-9-7-16(8-10-17)18(23)11-21-13-20-22(14-21)12-19(24)15-5-3-2-4-6-15/h2-10,13-14H,11-12H2,1H3/q+1
InChIKey
LQYGZFDWEKXUBW-UHFFFAOYSA-N
Synonyms

2(4(2(4METHOXYPHENYL)2OXOETHYL)124TRIAZOL4IUM1YL)1PHENYLETHANONE
4(2(4METHOXYPHENYL)2OXOETHYL)1(2OXO2PHENYLETHYL)1H124TRIAZOL4IUM
4(2(4methoxyphenyl)2oxoethyl)1(2oxo2phenylethyl)1H124triazol4iumbromide
COC1=CC=C(C=C1)C(=O)C(N+)2=CN(N=C2)CC(=O)C3=CC=CC=C3
COc1ccc(cc1)C(=O)C(n+)1cnn(c1)CC(=O)c1ccccc1
COc1ccc(cc1)C(=O)C(n+)1cnn(c1)CC(=O)c1ccccc1(Br)
InChI=1SC19H18N3O3c125179716(81017)18(23)1121132022(1421)1219(24)155324615h2101314H1112H21H3q+1
MFCD01067795
STK043223
ZINC000001835414
ZINC01835414
ZINC1835414

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Available files

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