Vitas-M small molecule compound
3-methyl-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL439133
SMILES O=C(c1[n+](C)nn(c1[O-])c1ccccc1)Nc1ccccc1
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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 C16H14N4O2 MW 294.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O2/c1-19-14(15(21)17-12-8-4-2-5-9-12)16(22)20(18-19)13-10-6-3-7-11-13/h2-11H,1H3,(H-,17,18,21,22)InChIKey
FYWAZZBGDCMHOT-UHFFFAOYSA-NSynonyms
1METHYL3PHENYL5(PHENYLCARBAMOYL)TRIAZOL1IUM4OLATE
3methyl1phenyl4(phenylcarbamoyl)1H123triazol3ium5olate
4(ANILINOCARBONYL)3METHYL1PHENYL1H123TRIAZOL3IUM5OLATE
C(N+)1=NN(C(=C1C(=O)NC2=CC=CC=C2)(O))C3=CC=CC=C3
InChI=1SC16H14N4O2c11914(15(21)17128425912)16(22)20(1819)13106371113h211H1H3(H17182122)
MFCD07773370
O=C(c1(n+)(C)nn(c1(O))c1ccccc1)Nc1ccccc1
ZINC000003765439
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