Vitas-M small molecule compound
2-chloro-5-{3-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK159542
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)C(=O)O)Cl)C)/c1ccc(cc1)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 C22H16Cl2N2O2 MW 411.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl2N2O2/c1-13-9-16(10-17(12-25)15-3-5-18(23)6-4-15)14(2)26(13)19-7-8-21(24)20(11-19)22(27)28/h3-11H,1-2H3,(H,27,28)/b17-10+InChIKey
XGRMTNLBEBORGX-LICLKQGHSA-NSynonyms
2CHLORO5(3((Z)2(4CHLOROPHENYL)2CYANOETHENYL)25DIMETHYL1HPYRROL1YL)BENZOICACID
2CHLORO5(3((Z)2(4CHLOROPHENYL)2CYANOETHENYL)25DIMETHYLPYRROL1YL)BENZOICACID
CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)C(=O)O)C)C=C(C#N)C3=CC=C(C=C3)Cl
InChI=1SC22H16Cl2N2O2c113916(1017(1225)153518(23)6415)14(2)26(13)197821(24)20(1119)22(27)28h311H12H3(H2728)b1710+
MFCD07084538
N#CC(=Cc1cc(n(c1C)c1ccc(c(c1)C(=O)O)Cl)C)c1ccc(cc1)Cl
ZINC000004688378
ZINC4688378
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