Vitas-M small molecule compound
ethyl 4-[({3-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}carbamothioyl)amino]benzoate
Catalog ID
STK307988
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCCCn1nc(cc1C1CC1)C(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 C20H23F3N4O2S MW 440.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23F3N4O2S/c1-2-29-18(28)14-6-8-15(9-7-14)25-19(30)24-10-3-11-27-16(13-4-5-13)12-17(26-27)20(21,22)23/h6-9,12-13H,2-5,10-11H2,1H3,(H2,24,25,30)InChIKey
SHTQAIXNIVZTMZ-UHFFFAOYSA-NSynonyms
894721-68-7894721687
CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCCN2C(=CC(=N2)C(F)(F)F)C3CC3
ethyl4(((3(5cyclopropyl3(trifluoromethyl)1Hpyrazol1yl)propyl)carbamothioyl)amino)benzoate
ETHYL4(3(5CYCLOPROPYL3(TRIFLUOROMETHYL)PYRAZOL1YL)PROPYLCARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC20H23F3N4O2Sc122918(28)146815(9714)2519(30)24103112716(134513)1217(2627)20(2122)23h691213H251011H21H3(H2242530)
MFCD04131522
ZINC000002794826
ZINC02794826
ZINC2794826
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