Vitas-M small molecule compound
2-[3-(benzyloxy)phenoxy]-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}acetamide
Catalog ID
STK345345
SMILES O=C(NC(=S)Nc1cc(ccc1N1CCCC1)C(F)(F)F)COc1cccc(c1)OCc1ccccc1
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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 C27H26F3N3O3S MW 529.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F3N3O3S/c28-27(29,30)20-11-12-24(33-13-4-5-14-33)23(15-20)31-26(37)32-25(34)18-36-22-10-6-9-21(16-22)35-17-19-7-2-1-3-8-19/h1-3,6-12,15-16H,4-5,13-14,17-18H2,(H2,31,32,34,37)InChIKey
MZLVSCDLHWPDHH-UHFFFAOYSA-NSynonyms
1(2(3BENZYLOXYPHENOXY)ACETYL)3(2PYRROLIDIN1YL5TRIFLUOROMETHYLPHENYL)THIOUREA
2(3(benzyloxy)phenoxy)N((2(pyrrolidin1yl)5(trifluoromethyl)phenyl)carbamothioyl)acetamide
2(3phenylmethoxyphenoxy)N((2pyrrolidin1yl5(trifluoromethyl)phenyl)carbamothioyl)acetamide
C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)COC3=CC=CC(=C3)OCC4=CC=CC=C4
InChI=1SC27H26F3N3O3Sc2827(2930)20111224(3313451433)23(1520)3126(37)3225(34)183622106921(1622)3517197213819h136121516H4513141718H2(H231323437)
MFCD09965040
ZINC000100019215
ZINC100019215
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