Vitas-M small molecule compound

2-(3,4-dimethylphenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidin-3-one

Catalog ID
STL482332
SMILES CC(CC1(C)NC(=O)N(N1)c1ccc(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 C15H23N3O MW 261.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H23N3O/c1-10(2)9-15(5)16-14(19)18(17-15)13-7-6-11(3)12(4)8-13/h6-8,10,17H,9H2,1-5H3,(H,16,19)
InChIKey
DQGXUGRPAYIVCO-UHFFFAOYSA-N
Synonyms

2(34dimethylphenyl)5methyl5(2methylpropyl)124triazolidin3one
CC1=C(C=C(C=C1)N2C(=O)NC(N2)(C)CC(C)C)C
InChI=1SC15H23N3Oc110(2)915(5)1614(19)18(1715)137611(3)12(4)813h681017H9H215H3(H1619)
MFCD30713263
ZINC000334160429
ZINC000334160430

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Available files

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