Vitas-M small molecule compound
4-({4-[(1Z)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]phenoxy}methyl)benzoic acid
Catalog ID
STK025808
SMILES N#C/C(=C/c1ccc(cc1)OCc1ccc(cc1)C(=O)O)/C(=O)NCc1ccccc1
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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 C25H20N2O4 MW 412.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O4/c26-15-22(24(28)27-16-19-4-2-1-3-5-19)14-18-8-12-23(13-9-18)31-17-20-6-10-21(11-7-20)25(29)30/h1-14H,16-17H2,(H,27,28)(H,29,30)/b22-14-InChIKey
CPILICKJALBYDF-HMAPJEAMSA-NSynonyms
4((4((1Z)3(BENZYLAMINO)2CYANO3OXOPROP1EN1YL)PHENOXY)METHYL)BENZOICACID
4((4((Z)3(BENZYLAMINO)2CYANO3OXOPROP1ENYL)PHENOXY)METHYL)BENZOICACID
C1=CC=C(C=C1)CNC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)C#N
InChI=1SC25H20N2O4c261522(24(28)2716194213519)141881223(13918)31172061021(11720)25(29)30h114H1617H2(H2728)(H2930)b2214
MFCD02052259
N#CC(=Cc1ccc(cc1)OCc1ccc(cc1)C(=O)O)C(=O)NCc1ccccc1
STK025808
ZINC000013940620
ZINC13940620
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