Vitas-M small molecule compound

N-benzyl-2-{[3-(1,1,2,2-tetrafluoroethoxy)phenyl]carbonyl}hydrazinecarbothioamide

Catalog ID
STL177695
SMILES S=C(NCc1ccccc1)NNC(=O)c1cccc(c1)OC(C(F)F)(F)F

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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 C17H15F4N3O2S MW 401.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F4N3O2S/c18-15(19)17(20,21)26-13-8-4-7-12(9-13)14(25)23-24-16(27)22-10-11-5-2-1-3-6-11/h1-9,15H,10H2,(H,23,25)(H2,22,24,27)
InChIKey
JLGJTBMURQSWKL-UHFFFAOYSA-N
Synonyms

1benzyl3((3(1122tetrafluoroethoxy)benzoyl)amino)thiourea
C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC(=CC=C2)OC(C(F)F)(F)F
InChI=1SC17H15F4N3O2Sc1815(19)17(2021)261384712(913)14(25)232416(27)2210115213611h1915H10H2(H2325)(H2222427)
MFCD04054001
Nbenzyl2((3(1122tetrafluoroethoxy)phenyl)carbonyl)hydrazinecarbothioamide
ZINC000002793917
ZINC02793917
ZINC2793917

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Available files

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