Vitas-M small molecule compound
2-ethoxy-4-(piperidin-1-ylcarbonothioyl)phenyl 2-fluorobenzoate
Catalog ID
STK082773
SMILES CCOc1cc(ccc1OC(=O)c1ccccc1F)C(=S)N1CCCCC1
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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 C21H22FNO3S MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FNO3S/c1-2-25-19-14-15(20(27)23-12-6-3-7-13-23)10-11-18(19)26-21(24)16-8-4-5-9-17(16)22/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3InChIKey
XNXWETNQBGMVMP-UHFFFAOYSA-NSynonyms
(2ETHOXY4(PIPERIDINE1CARBOTHIOYL)PHENYL)2FLUOROBENZOATE
2ETHOXY4(PIPERIDIN1YLCARBONOTHIOYL)PHENYL2FLUOROBENZOATE
CCOC1=C(C=CC(=C1)C(=S)N2CCCCC2)OC(=O)C3=CC=CC=C3F
CCOc1cc(ccc1OC(=O)c1ccccc1F)C(=S)N1CCCCC1
InChI=1SC21H22FNO3Sc1225191415(20(27)23126371323)101118(19)2621(24)16845917(16)22h4581114H23671213H21H3
MFCD02904341
STK082773
ZINC000004672158
ZINC04672158
ZINC4672158
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