Vitas-M small molecule compound
1-[3-(diethylamino)propyl]-3-{3,5-dimethyl-1-[3-(trifluoromethyl)benzyl]-1H-pyrazol-4-yl}thiourea
Catalog ID
STL399181
SMILES CCN(CCCNC(=S)Nc1c(C)nn(c1C)Cc1cccc(c1)C(F)(F)F)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 C21H30F3N5S MW 441.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30F3N5S/c1-5-28(6-2)12-8-11-25-20(30)26-19-15(3)27-29(16(19)4)14-17-9-7-10-18(13-17)21(22,23)24/h7,9-10,13H,5-6,8,11-12,14H2,1-4H3,(H2,25,26,30)InChIKey
GFOLFBVOVRYGBA-UHFFFAOYSA-NSynonyms
1005687-86-41(3(DIETHYLAMINO)PROPYL)3(35DIMETHYL1((3(TRIFLUOROMETHYL)PHENYL)METHYL)PYRAZOL4YL)THIOUREA
1(3(DIETHYLAMINO)PROPYL)3(35DIMETHYL1(3(TRIFLUOROMETHYL)BENZYL)1HPYRAZOL4YL)THIOUREA
1005687864
CCN(CC)CCCNC(=S)NC1=C(N(N=C1C)CC2=CC(=CC=C2)C(F)(F)F)C
InChI=1SC21H30F3N5Sc1528(62)128112520(30)261915(3)2729(16(19)4)1417971018(1317)21(2223)24h791013H568111214H214H3(H2252630)
MFCD04130864
ZINC000002793927
ZINC2793927
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