Vitas-M small molecule compound
[1-(5-fluoro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl](4-methyl-1,4-diazepan-1-yl)methanone
Catalog ID
STL127926
SMILES CN1CCCN(CC1)C(=O)c1nnn(c1C)c1cc(F)ccc1C
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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 C17H22FN5O MW 331.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22FN5O/c1-12-5-6-14(18)11-15(12)23-13(2)16(19-20-23)17(24)22-8-4-7-21(3)9-10-22/h5-6,11H,4,7-10H2,1-3H3InChIKey
KGAMRRQWIBYMEX-UHFFFAOYSA-NSynonyms
(1(5fluoro2methylphenyl)5methyl1H123triazol4yl)(4methyl14diazepan1yl)methanone
(1(5fluoro2methylphenyl)5methyltriazol4yl)(4methyl14diazepan1yl)methanone
CC1=C(C=C(C=C1)F)N2C(=C(N=N2)C(=O)N3CCCN(CC3)C)C
InChI=1SC17H22FN5Oc1125614(18)1115(12)2313(2)16(192023)17(24)2284721(3)91022h5611H4710H213H3
MFCD20740860
ZINC000067283406
ZINC67283406
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