Vitas-M small molecule compound
4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)-1-[2-(4-methoxyphenyl)-2-oxoethyl]pyridinium
Catalog ID
STL059277
SMILES COc1ccc(cc1)C(=O)C[n+]1ccc(cc1)c1nnc2n1CCC2
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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 C19H19N4O2 MW 335.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N4O2/c1-25-16-6-4-14(5-7-16)17(24)13-22-11-8-15(9-12-22)19-21-20-18-3-2-10-23(18)19/h4-9,11-12H,2-3,10,13H2,1H3/q+1InChIKey
BKLXSNUWBYMAQM-UHFFFAOYSA-NSynonyms
1(4METHOXYPHENYL)2(4PYRROLIDINO(12D)124TRIAZOL3YLPYRIDYL)ETHAN1ONE
2(4(67DIHYDRO5HPYRROLO(21C)(124)TRIAZOL3YL)PYRIDIN1IUM1YL)1(4METHOXYPHENYL)ETHANONE
4(67dihydro5Hpyrrolo(21c)(124)triazol3yl)1(2(4methoxyphenyl)2oxoethyl)pyridin1iumbromide
4(67dihydro5Hpyrrolo(21c)(124)triazol3yl)1(2(4methoxyphenyl)2oxoethyl)pyridinium
COC1=CC=C(C=C1)C(=O)C(N+)2=CC=C(C=C2)C3=NN=C4N3CCC4
COc1ccc(cc1)C(=O)C(n+)1ccc(cc1)c1nnc2n1CCC2
COc1ccc(cc1)C(=O)C(n+)1ccc(cc1)c1nnc2n1CCC2(Br)
InChI=1SC19H19N4O2c125166414(5716)17(24)132211815(91222)19212018321023(18)19h491112H231013H21H3q+1
ZINC000001749282
ZINC01749282
ZINC1749282
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