Vitas-M small molecule compound
4-chloro-3-(5-{(1E)-3-[(5-chloro-2-methylphenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK047925
SMILES N#C/C(=C\c1ccc(o1)c1cc(ccc1Cl)C(=O)O)/C(=O)Nc1cc(Cl)ccc1C
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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 C22H14Cl2N2O4 MW 441.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl2N2O4/c1-12-2-4-15(23)10-19(12)26-21(27)14(11-25)8-16-5-7-20(30-16)17-9-13(22(28)29)3-6-18(17)24/h2-10H,1H3,(H,26,27)(H,28,29)/b14-8+InChIKey
FAJUZTNJSZPXQN-RIYZIHGNSA-NSynonyms
358745-63-8358745638
4CHLORO3(5((1E)3((5CHLORO2METHYLPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
4CHLORO3(5((E)3(5CHLORO2METHYLANILINO)2CYANO3OXOPROP1ENYL)FURAN2YL)BENZOICACID
CC1=C(C=C(C=C1)Cl)NC(=O)C(=CC2=CC=C(O2)C3=C(C=CC(=C3)C(=O)O)Cl)C#N
InChI=1SC22H14Cl2N2O4c1122415(23)1019(12)2621(27)14(1125)8165720(3016)17913(22(28)29)3618(17)24h210H1H3(H2627)(H2829)b148+
MFCD02611930
N#CC(=Cc1ccc(o1)c1cc(ccc1Cl)C(=O)O)C(=O)Nc1cc(Cl)ccc1C
STK047925
ZINC000009311554
ZINC9311554
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