Vitas-M small molecule compound
[1-(3,4-dimethylphenyl)-1H-1,2,3-triazol-4-yl][4-(furan-2-ylcarbonyl)piperazin-1-yl]methanone
Catalog ID
STL127468
SMILES O=C(c1nnn(c1)c1ccc(c(c1)C)C)N1CCN(CC1)C(=O)c1ccco1
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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 C20H21N5O3 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3/c1-14-5-6-16(12-15(14)2)25-13-17(21-22-25)19(26)23-7-9-24(10-8-23)20(27)18-4-3-11-28-18/h3-6,11-13H,7-10H2,1-2H3InChIKey
KXCFUOWYEZSTFS-UHFFFAOYSA-NSynonyms
(1(34dimethylphenyl)1H123triazol4yl)(4(furan2ylcarbonyl)piperazin1yl)methanone
(4(1(34dimethylphenyl)triazole4carbonyl)piperazin1yl)(furan2yl)methanone
CC1=C(C=C(C=C1)N2C=C(N=N2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4)C
InChI=1SC20H21N5O3c1145616(1215(14)2)251317(212225)19(26)237924(10823)20(27)1843112818h361113H710H212H3
MFCD20740378
ZINC000067263079
ZINC67263079
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