Vitas-M small molecule compound
3-ethyl-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL441166
SMILES CC[n+]1nn(c(c1C(=O)Nc1ccccc1)[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 C17H16N4O2 MW 308.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O2/c1-2-20-15(16(22)18-13-9-5-3-6-10-13)17(23)21(19-20)14-11-7-4-8-12-14/h3-12H,2H2,1H3,(H-,18,19,22,23)InChIKey
VKUIOVYFKMTLPE-UHFFFAOYSA-NSynonyms
1ETHYL3PHENYL5(PHENYLCARBAMOYL)TRIAZOL1IUM4OLATE
3ethyl1phenyl4(phenylcarbamoyl)1H123triazol3ium5olate
4(ANILINOCARBONYL)3ETHYL1PHENYL1H123TRIAZOL3IUM5OLATE
CC(N+)1=NN(C(=C1C(=O)NC2=CC=CC=C2)(O))C3=CC=CC=C3
CC(n+)1nn(c(c1C(=O)Nc1ccccc1)(O))c1ccccc1
InChI=1SC17H16N4O2c122015(16(22)181395361013)17(23)21(1920)14117481214h312H2H21H3(H18192223)
MFCD07755320
ZINC000003765441
ZINC03765441
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