Vitas-M small molecule compound
(2E)-N-{2-[(2-chloro-6-fluorobenzyl)sulfanyl]ethyl}-3-(3-nitrophenyl)-2-phenylprop-2-enamide
Catalog ID
STL061405
SMILES O=C(/C(=C/c1cccc(c1)[N+](=O)[O-])/c1ccccc1)NCCSCc1c(F)cccc1Cl
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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 C24H20ClFN2O3S MW 470.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClFN2O3S/c25-22-10-5-11-23(26)21(22)16-32-13-12-27-24(29)20(18-7-2-1-3-8-18)15-17-6-4-9-19(14-17)28(30)31/h1-11,14-15H,12-13,16H2,(H,27,29)/b20-15+InChIKey
SNVFJHOLEBWRRO-HMMYKYKNSA-NSynonyms
(2E)N(2((2chloro6fluorobenzyl)sulfanyl)ethyl)3(3nitrophenyl)2phenylprop2enamide
(E)N(2((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)ETHYL)3(3NITROPHENYL)2PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C(=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)NCCSCC3=C(C=CC=C3Cl)F
InChI=1SC24H20ClFN2O3Sc25221051123(26)21(22)163213122724(29)20(187213818)151764919(1417)28(30)31h1111415H121316H2(H2729)b2015+
MFCD03573535
O=C(C(=Cc1cccc(c1)(N+)(=O)(O))c1ccccc1)NCCSCc1c(F)cccc1Cl
ZINC000016225573
ZINC16225573
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