Vitas-M small molecule compound
2-{[(2E)-2-{[(4-bromophenyl)carbonyl]amino}-3-(4-fluorophenyl)prop-2-enoyl]amino}octanoic acid
Catalog ID
STK534252
SMILES CCCCCCC(C(=O)O)NC(=O)/C(=C\c1ccc(cc1)F)/NC(=O)c1ccc(cc1)Br
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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 C24H26BrFN2O4 MW 505.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26BrFN2O4/c1-2-3-4-5-6-20(24(31)32)27-23(30)21(15-16-7-13-19(26)14-8-16)28-22(29)17-9-11-18(25)12-10-17/h7-15,20H,2-6H2,1H3,(H,27,30)(H,28,29)(H,31,32)/b21-15+InChIKey
LWWFXOOUEQKWFQ-RCCKNPSSSA-NSynonyms
(E)2(2(4bromobenzamido)3(4fluorophenyl)acrylamido)octanoicacid
2(((2E)2(((4bromophenyl)carbonyl)amino)3(4fluorophenyl)prop2enoyl)amino)octanoicacid
2(((E)2((4BROMOBENZOYL)AMINO)3(4FLUOROPHENYL)PROP2ENOYL)AMINO)OCTANOICACID
CCCCCCC(C(=O)O)NC(=O)C(=CC1=CC=C(C=C1)F)NC(=O)C2=CC=C(C=C2)Br
CCCCCCC(C(=O)O)NC(=O)C(=Cc1ccc(cc1)F)NC(=O)c1ccc(cc1)Br
InChI=1SC24H26BrFN2O4c12345620(24(31)32)2723(30)21(151671319(26)14816)2822(29)1791118(25)121017h71520H26H21H3(H2730)(H2829)(H3132)b2115+
MFCD02988195
ZINC000009309979
ZINC000009309980
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