Vitas-M small molecule compound
3-benzyl-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL441165
SMILES O=C(c1[n+](Cc2ccccc2)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 C22H18N4O2 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O2/c27-21(23-18-12-6-2-7-13-18)20-22(28)26(19-14-8-3-9-15-19)24-25(20)16-17-10-4-1-5-11-17/h1-15H,16H2,(H-,23,24,27,28)InChIKey
XRIZILDIRCELJQ-UHFFFAOYSA-NSynonyms
1BENZYL3PHENYL5(PHENYLCARBAMOYL)TRIAZOL1IUM4OLATE
3benzyl1phenyl4(phenylcarbamoyl)1H123triazol3ium5olate
4(ANILINOCARBONYL)3BENZYL1PHENYL1H123TRIAZOL3IUM5OLATE
C1=CC=C(C=C1)C(N+)2=NN(C(=C2C(=O)NC3=CC=CC=C3)(O))C4=CC=CC=C4
InChI=1SC22H18N4O2c2721(2318126271318)2022(28)26(19148391519)2425(20)1617104151117h115H16H2(H23242728)
MFCD07397451
O=C(c1(n+)(Cc2ccccc2)nn(c1(O))c1ccccc1)Nc1ccccc1
ZINC000003765438
ZINC03765438
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