Vitas-M small molecule compound

1-(2-ethylhexyl)-3-(4-methylbenzyl)thiourea

Catalog ID
STK493729
SMILES CCCCC(CNC(=S)NCc1ccc(cc1)C)CC

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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 C17H28N2S MW 292.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H28N2S/c1-4-6-7-15(5-2)12-18-17(20)19-13-16-10-8-14(3)9-11-16/h8-11,15H,4-7,12-13H2,1-3H3,(H2,18,19,20)
InChIKey
VAOBKQUMDLAMGL-UHFFFAOYSA-N
Synonyms
890321-85-4
((2ETHYLHEXYL)AMINO)(((4METHYLPHENYL)METHYL)AMINO)METHANE1THIONE
1(2ethylhexyl)3((4methylphenyl)methyl)thiourea
1(2ethylhexyl)3(4methylbenzyl)thiourea
890321854
CCCCC(CC)CNC(=S)NCC1=CC=C(C=C1)C
InChI=1SC17H28N2Sc146715(52)121817(20)19131610814(3)91116h81115H471213H213H3(H2181920)
MFCD06055296
ZINC000013820148
ZINC000013820150

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Available files

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