Vitas-M small molecule compound
[1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Catalog ID
STL127953
SMILES Clc1cccc(c1)n1nnc(c1)C(=O)N1CCN(CC1)c1ncccn1
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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 C17H16ClN7O MW 369.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN7O/c18-13-3-1-4-14(11-13)25-12-15(21-22-25)16(26)23-7-9-24(10-8-23)17-19-5-2-6-20-17/h1-6,11-12H,7-10H2InChIKey
OAUDOICQSKLLSL-UHFFFAOYSA-NSynonyms
(1(3chlorophenyl)1H123triazol4yl)(4(pyrimidin2yl)piperazin1yl)methanone
(1(3chlorophenyl)triazol4yl)(4pyrimidin2ylpiperazin1yl)methanone
C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CN(N=N3)C4=CC(=CC=C4)Cl
InChI=1SC17H16ClN7Oc181331414(1113)251215(212225)16(26)237924(10823)17195262017h161112H710H2
MFCD20740884
ZINC000067283458
ZINC67283458
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