Vitas-M small molecule compound
1-(5-amino-3-phenyl-1H-1,2,4-triazol-1-yl)butan-1-one
Catalog ID
STK114271
SMILES CCCC(=O)n1nc(nc1N)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 C12H14N4O MW 230.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O/c1-2-6-10(17)16-12(13)14-11(15-16)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3,(H2,13,14,15)InChIKey
BZLRZNISTORZEP-UHFFFAOYSA-NSynonyms
1(5AMINO3PHENYL124TRIAZOL1YL)BUTAN1ONE
1(5AMINO3PHENYL1H124TRIAZOL1YL)BUTAN1ONE
1BUTYRYL3PHENYL1H124TRIAZOL5AMINE
CCCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)N
InChI=1SC12H14N4Oc12610(17)1612(13)1411(1516)9743589h3578H26H21H3(H2131415)
MFCD04088483
ZINC000000350117
ZINC00350117
ZINC350117
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