Vitas-M small molecule compound

[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl][4-(4-methylphenyl)piperazin-1-yl]methanone

Catalog ID
STK986444
SMILES Cc1ccc(cc1)N1CCN(CC1)C(=O)c1nnn(c1C)c1ccc(c(c1)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 C23H27N5O MW 389.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O/c1-16-5-8-20(9-6-16)26-11-13-27(14-12-26)23(29)22-19(4)28(25-24-22)21-10-7-17(2)18(3)15-21/h5-10,15H,11-14H2,1-4H3
InChIKey
LEAQLQQLBVDDQH-UHFFFAOYSA-N
Synonyms

(1(34dimethylphenyl)5methyl1H123triazol4yl)(4(4methylphenyl)piperazin1yl)methanone
(1(34dimethylphenyl)5methyltriazol4yl)(4(4methylphenyl)piperazin1yl)methanone
CC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(N(N=N3)C4=CC(=C(C=C4)C)C)C
InChI=1SC23H27N5Oc1165820(9616)26111327(141226)23(29)2219(4)28(252422)2110717(2)18(3)1521h51015H1114H214H3
MFCD18183342
ZINC000051317543
ZINC51317543

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.