Vitas-M small molecule compound
[4-(5-chloro-2-methylphenyl)piperazin-1-yl]{5-[(3,4-dimethylphenyl)amino]-1H-1,2,3-triazol-4-yl}methanone
Catalog ID
STL098908
SMILES Clc1ccc(c(c1)N1CCN(CC1)C(=O)c1nn[nH]c1Nc1ccc(c(c1)C)C)C
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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 C22H25ClN6O MW 424.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN6O/c1-14-5-7-18(12-16(14)3)24-21-20(25-27-26-21)22(30)29-10-8-28(9-11-29)19-13-17(23)6-4-15(19)2/h4-7,12-13H,8-11H2,1-3H3,(H2,24,25,26,27)InChIKey
LEANRTGKEUVBSU-UHFFFAOYSA-NSynonyms
(4(5chloro2methylphenyl)piperazin1yl)(5((34dimethylphenyl)amino)1H123triazol4yl)methanone
(4(5chloro2methylphenyl)piperazin1yl)(5(34dimethylanilino)2Htriazol4yl)methanone
CC1=C(C=C(C=C1)NC2=NNN=C2C(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C
Clc1ccc(c(c1)N1CCN(CC1)C(=O)c1nn(nH)c1Nc1ccc(c(c1)C)C)C
InChI=1SC22H25ClN6Oc1145718(1216(14)3)242120(25272621)22(30)2910828(91129)191317(23)6415(19)2h471213H811H213H3(H224252627)
MFCD18790151
ZINC000067284572
ZINC67284572
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