Vitas-M small molecule compound
6-amino-2,5-bis(4-methylphenyl)-4-oxo-4,5-dihydro-2H-[1,2,3]triazolo[1,5-a]pyrazin-8-ium-3-olate
Catalog ID
STL448405
SMILES Cc1ccc(cc1)n1n[n+]2c(c1[O-])c(=O)n(c(c2)N)c1ccc(cc1)C
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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 C19H17N5O2 MW 347.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O2/c1-12-3-7-14(8-4-12)23-16(20)11-22-17(18(23)25)19(26)24(21-22)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H2-,20,21,25,26)InChIKey
WNPOHGNQJMSKQC-UHFFFAOYSA-NSynonyms
6AMINO25BIS(4METHYLPHENYL)3OXOTRIAZOLO(15A)PYRAZIN8IUM4OLATE
6amino25bis(4methylphenyl)4oxo45dihydro2H(123)triazolo(15a)pyrazin8ium3olate
CC1=CC=C(C=C1)N2C(=C(N+)3=NN(C(=O)C3=C2(O))C4=CC=C(C=C4)C)N
Cc1ccc(cc1)n1n(n+)2c(c1(O))c(=O)n(c(c2)N)c1ccc(cc1)C
InChI=1SC19H17N5O2c1123714(8412)2316(20)112217(18(23)25)19(26)24(2122)159513(2)61015h311H12H3(H220212526)
MFCD07773846
ZINC000008507844
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