Vitas-M small molecule compound
4-{4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STK568487
SMILES Cc1ccc(cc1)OCCN1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)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 C20H24F3N5O3S MW 471.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24F3N5O3S/c1-14-2-4-15(5-3-14)31-13-12-27-8-10-28(11-9-27)17(30)7-6-16(29)24-19-26-25-18(32-19)20(21,22)23/h2-5H,6-13H2,1H3,(H,24,26,29)InChIKey
LTMZOGUQMYKZDY-UHFFFAOYSA-NSynonyms
714944-21-54(4(2(4methylphenoxy)ethyl)piperazin1yl)4oxoN((2Z)5(trifluoromethyl)134thiadiazol2(3H)ylidene)butanamide
4(4(2(4METHYLPHENOXY)ETHYL)PIPERAZIN1YL)4OXON(5(TRIFLUOROMETHYL)134THIADIAZOL2YL)BUTANAMIDE
714944215
CC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F
Cc1ccc(cc1)OCCN1CCN(CC1)C(=O)CCC(=O)N=c1(nH)nc(s1)C(F)(F)F
InChI=1SC20H24F3N5O3Sc1142415(5314)3113122781028(11927)17(30)7616(29)2419262518(3219)20(2122)23h25H613H21H3(H242629)
MFCD05737020
ZINC000016956016
ZINC16956016
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