Vitas-M small molecule compound
[1-(3,5-dimethylphenyl)-1H-1,2,3-triazol-4-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Catalog ID
STL142188
SMILES Cc1cc(C)cc(c1)n1nnc(c1)C(=O)N1CCN(CC1)c1ccccc1F
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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 C21H22FN5O MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN5O/c1-15-11-16(2)13-17(12-15)27-14-19(23-24-27)21(28)26-9-7-25(8-10-26)20-6-4-3-5-18(20)22/h3-6,11-14H,7-10H2,1-2H3InChIKey
IEIQDAHJDZSZQO-UHFFFAOYSA-NSynonyms
(1(35dimethylphenyl)1H123triazol4yl)(4(2fluorophenyl)piperazin1yl)methanone
(1(35dimethylphenyl)triazol4yl)(4(2fluorophenyl)piperazin1yl)methanone
CC1=CC(=CC(=C1)N2C=C(N=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4F)C
InChI=1SC21H22FN5Oc1151116(2)1317(1215)271419(232427)21(28)269725(81026)20643518(20)22h361114H710H212H3
MFCD20740470
ZINC000071326461
ZINC71326461
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