Vitas-M small molecule compound
4-(5-{(1Z)-3-[(4-chloro-2-methylphenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK181040
SMILES N#C/C(=C/c1ccc(o1)c1ccc(cc1)C(=O)O)/C(=O)Nc1ccc(cc1C)Cl
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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/c1-13-10-17(23)6-8-19(13)25-21(26)16(12-24)11-18-7-9-20(29-18)14-2-4-15(5-3-14)22(27)28/h2-11H,1H3,(H,25,26)(H,27,28)/b16-11-InChIKey
BAICZENQHSYXNT-WJDWOHSUSA-NSynonyms
4(5((1Z)3((4CHLORO2METHYLPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
4(5((Z)3(4CHLORO2METHYLANILINO)2CYANO3OXOPROP1ENYL)FURAN2YL)BENZOICACID
CC1=C(C=CC(=C1)Cl)NC(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)C#N
InChI=1SC22H15ClN2O4c1131017(23)6819(13)2521(26)16(1224)11187920(2918)142415(5314)22(27)28h211H1H3(H2526)(H2728)b1611
MFCD05041109
N#CC(=Cc1ccc(o1)c1ccc(cc1)C(=O)O)C(=O)Nc1ccc(cc1C)Cl
ZINC000004705389
ZINC4705389
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