Vitas-M small molecule compound
3-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}phenyl 4-chlorobenzoate
Catalog ID
STK153990
SMILES N#C/C(=C\c1cccc(c1)OC(=O)c1ccc(cc1)Cl)/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 C22H15ClN2O4 MW 406.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN2O4/c23-18-8-6-16(7-9-18)22(27)29-19-4-1-3-15(12-19)11-17(13-24)21(26)25-14-20-5-2-10-28-20/h1-12H,14H2,(H,25,26)/b17-11+InChIKey
WUFXLGZNEBMSMU-GZTJUZNOSA-NSynonyms
(3((E)2CYANO3(FURAN2YLMETHYLAMINO)3OXOPROP1ENYL)PHENYL)4CHLOROBENZOATE
3((1E)2CYANO3((FURAN2YLMETHYL)AMINO)3OXOPROP1EN1YL)PHENYL4CHLOROBENZOATE
C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)Cl)C=C(C#N)C(=O)NCC3=CC=CO3
InChI=1SC22H15ClN2O4c23188616(7918)22(27)291941315(1219)1117(1324)21(26)25142052102820h112H14H2(H2526)b1711+
MFCD08673210
N#CC(=Cc1cccc(c1)OC(=O)c1ccc(cc1)Cl)C(=O)NCc1ccco1
ZINC000004694964
ZINC04694964
ZINC4694964
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