Vitas-M small molecule compound
4-chloro-3-(5-{(1Z)-2-cyano-3-[(3-methylphenyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK182718
SMILES N#C/C(=C/c1ccc(o1)c1cc(ccc1Cl)C(=O)O)/C(=O)Nc1cccc(c1)C
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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/c1-13-3-2-4-16(9-13)25-21(26)15(12-24)10-17-6-8-20(29-17)18-11-14(22(27)28)5-7-19(18)23/h2-11H,1H3,(H,25,26)(H,27,28)/b15-10-InChIKey
BGOHHZKNFAWANJ-GDNBJRDFSA-NSynonyms
4CHLORO3(5((1Z)2CYANO3((3METHYLPHENYL)AMINO)3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
4CHLORO3(5((Z)2CYANO3(3METHYLANILINO)3OXOPROP1ENYL)FURAN2YL)BENZOICACID
CC1=CC(=CC=C1)NC(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)C(=O)O)Cl)C#N
InChI=1SC22H15ClN2O4c11332416(913)2521(26)15(1224)10176820(2917)181114(22(27)28)5719(18)23h211H1H3(H2526)(H2728)b1510
MFCD04561936
N#CC(=Cc1ccc(o1)c1cc(ccc1Cl)C(=O)O)C(=O)Nc1cccc(c1)C
ZINC000004723132
ZINC4723132
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