Vitas-M small molecule compound
4-ethyl-N-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}carbonothioyl)benzamide
Catalog ID
STK259422
SMILES CCc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])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 C21H21F3N4O3S MW 466.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N4O3S/c1-2-14-3-5-15(6-4-14)19(29)25-20(32)27-11-9-26(10-12-27)17-8-7-16(21(22,23)24)13-18(17)28(30)31/h3-8,13H,2,9-12H2,1H3,(H,25,29,32)InChIKey
QADOYEGVIRIIBH-UHFFFAOYSA-NSynonyms
4ethylN((4(2nitro4(trifluoromethyl)phenyl)piperazin1yl)carbonothioyl)benzamide
4ETHYLN(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINE1CARBOTHIOYL)BENZAMIDE
CCC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
CCc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC21H21F3N4O3Sc12143515(6414)19(29)2520(32)2711926(101227)178716(21(2223)24)1318(17)28(30)31h3813H2912H21H3(H252932)
MFCD04096408
ZINC000009426138
ZINC09426138
ZINC9426138
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