Vitas-M small molecule compound

5-methyl-2-(4-methylphenyl)-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione

Catalog ID
STK763918
SMILES CC(CC1(C)NC(=S)N(N1)c1ccc(cc1)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 C14H21N3S MW 263.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N3S/c1-10(2)9-14(4)15-13(18)17(16-14)12-7-5-11(3)6-8-12/h5-8,10,16H,9H2,1-4H3,(H,15,18)
InChIKey
SPUODDJXKPLDBH-UHFFFAOYSA-N
Synonyms

5ISOBUTYL5METHYL2(4METHYLPHENYL)124TRIAZOLIDINE3THIONE
5ISOBUTYL5METHYL2PTOLYL(124)TRIAZOLIDINE3THIONE
5methyl2(4methylphenyl)5(2methylpropyl)124triazolidine3thione
CC1=CC=C(C=C1)N2C(=S)NC(N2)(C)CC(C)C
InChI=1SC14H21N3Sc110(2)914(4)1513(18)17(1614)127511(3)6812h581016H9H214H3(H1518)
MFCD02647862
ZINC000000087213
ZINC000000087217

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Available files

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