Vitas-M small molecule compound
ethyl 4-[({4-[2-(2-fluorophenyl)ethyl]piperidin-1-yl}carbonothioyl)amino]benzoate
Catalog ID
STK212809
SMILES CCOC(=O)c1ccc(cc1)NC(=S)N1CCC(CC1)CCc1ccccc1F
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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 C23H27FN2O2S MW 414.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27FN2O2S/c1-2-28-22(27)19-9-11-20(12-10-19)25-23(29)26-15-13-17(14-16-26)7-8-18-5-3-4-6-21(18)24/h3-6,9-12,17H,2,7-8,13-16H2,1H3,(H,25,29)InChIKey
LJEFJTJEUANWNT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)CCC3=CC=CC=C3F
ETHYL4(((4(2(2FLUOROPHENYL)ETHYL)PIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZOATE
ETHYL4((4(2(2FLUOROPHENYL)ETHYL)PIPERIDINE1CARBOTHIOYL)AMINO)BENZOATE
InChI=1SC23H27FN2O2Sc122822(27)1991120(121019)2523(29)26151317(141626)7818534621(18)24h3691217H2781316H21H3(H2529)
MFCD07657445
ZINC000004709731
ZINC04709731
ZINC4709731
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