Vitas-M small molecule compound
3-(2-ethoxy-2-oxoethyl)-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL448376
SMILES CCOC(=O)C[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 C19H18N4O4 MW 366.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O4/c1-2-27-16(24)13-22-17(18(25)20-14-9-5-3-6-10-14)19(26)23(21-22)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3,(H-,20,21,25,26)InChIKey
ZEHAOOXPIRXALZ-UHFFFAOYSA-NSynonyms
1(2ETHOXY2OXOETHYL)3PHENYL5(PHENYLCARBAMOYL)TRIAZOL1IUM4OLATE
3(2ethoxy2oxoethyl)1phenyl4(phenylcarbamoyl)1H123triazol3ium5olate
4(ANILINOCARBONYL)3(2ETHOXY2OXOETHYL)1PHENYL1H123TRIAZOL3IUM5OLATE
CCOC(=O)C(N+)1=NN(C(=C1C(=O)NC2=CC=CC=C2)(O))C3=CC=CC=C3
CCOC(=O)C(n+)1nn(c(c1C(=O)Nc1ccccc1)(O))c1ccccc1
InChI=1SC19H18N4O4c122716(24)132217(18(25)201495361014)19(26)23(2122)15117481215h312H213H21H3(H20212526)
MFCD07773829
ZINC000005274769
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