Vitas-M small molecule compound

1-butyl-3-(5-tert-butyl-2-methoxyphenyl)thiourea

Catalog ID
STK493472
SMILES CCCCNC(=S)Nc1cc(ccc1OC)C(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 C16H26N2OS MW 294.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N2OS/c1-6-7-10-17-15(20)18-13-11-12(16(2,3)4)8-9-14(13)19-5/h8-9,11H,6-7,10H2,1-5H3,(H2,17,18,20)
InChIKey
GYBUBWUMGNLOMF-UHFFFAOYSA-N
Synonyms

1butyl3(5tertbutyl2methoxyphenyl)thiourea
CCCCNC(=S)NC1=C(C=CC(=C1)C(C)(C)C)OC
InChI=1SC16H26N2OSc167101715(20)18131112(16(23)4)8914(13)195h8911H6710H215H3(H2171820)
MFCD06055837
ZINC000013794170
ZINC13794170

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Available files

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