Vitas-M small molecule compound
3-[(4-{(1E)-2-cyano-3-oxo-3-[(tetrahydrofuran-2-ylmethyl)amino]prop-1-en-1-yl}phenoxy)methyl]benzoic acid
Catalog ID
STK179100
SMILES N#C/C(=C\c1ccc(cc1)OCc1cccc(c1)C(=O)O)/C(=O)NCC1CCCO1
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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 C23H22N2O5 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5/c24-13-19(22(26)25-14-21-5-2-10-29-21)11-16-6-8-20(9-7-16)30-15-17-3-1-4-18(12-17)23(27)28/h1,3-4,6-9,11-12,21H,2,5,10,14-15H2,(H,25,26)(H,27,28)/b19-11+InChIKey
PZMQJUCNHYYCIV-YBFXNURJSA-NSynonyms
3((4((1E)2CYANO2(N(OXOLAN2YLMETHYL)CARBAMOYL)VINYL)PHENOXY)METHYL)BENZOICACID
3((4((1E)2CYANO3OXO3((TETRAHYDROFURAN2YLMETHYL)AMINO)PROP1EN1YL)PHENOXY)METHYL)BENZOICACID
3((4((E)2CYANO3OXO3(OXOLAN2YLMETHYLAMINO)PROP1ENYL)PHENOXY)METHYL)BENZOICACID
C1CC(OC1)CNC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O)C#N
InChI=1SC23H22N2O5c241319(22(26)25142152102921)11166820(9716)30151731418(1217)23(27)28h13469111221H25101415H2(H2526)(H2728)b1911+
MFCD03834859
N#CC(=Cc1ccc(cc1)OCc1cccc(c1)C(=O)O)C(=O)NCC1CCCO1
ZINC000004525053
ZINC000004525054
Check stock
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