Vitas-M small molecule compound
ethyl N-{(2E)-3-(2-fluorophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}threoninate
Catalog ID
STK805930
SMILES CCOC(=O)C(C(O)C)NC(=O)/C(=C\c1ccccc1F)/NC(=O)c1ccccc1
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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 C22H23FN2O5 MW 414.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN2O5/c1-3-30-22(29)19(14(2)26)25-21(28)18(13-16-11-7-8-12-17(16)23)24-20(27)15-9-5-4-6-10-15/h4-14,19,26H,3H2,1-2H3,(H,24,27)(H,25,28)/b18-13+InChIKey
RKCCPANIHQFLIY-QGOAFFKASA-NSynonyms
(E)ethyl2(2benzamido3(2fluorophenyl)acrylamido)3hydroxybutanoate
CCOC(=O)C(C(C)O)NC(=O)C(=CC1=CC=CC=C1F)NC(=O)C2=CC=CC=C2
CCOC(=O)C(C(O)C)NC(=O)C(=Cc1ccccc1F)NC(=O)c1ccccc1
ETHYL2(((E)2BENZAMIDO3(2FLUOROPHENYL)PROP2ENOYL)AMINO)3HYDROXYBUTANOATE
ethylN((2E)3(2fluorophenyl)2((phenylcarbonyl)amino)prop2enoyl)threoninate
InChI=1SC22H23FN2O5c133022(29)19(14(2)26)2521(28)18(131611781217(16)23)2420(27)1595461015h4141926H3H212H3(H2427)(H2528)b1813+
MFCD01046804
ZINC000004771013
ZINC000004771022
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