Vitas-M small molecule compound
4-(5-{(1Z)-2-cyano-3-[(3-methylphenyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)-3-methylbenzoic acid
Catalog ID
STK081287
SMILES N#C/C(=C/c1ccc(o1)c1ccc(cc1C)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 C23H18N2O4 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O4/c1-14-4-3-5-18(10-14)25-22(26)17(13-24)12-19-7-9-21(29-19)20-8-6-16(23(27)28)11-15(20)2/h3-12H,1-2H3,(H,25,26)(H,27,28)/b17-12-InChIKey
WPAHNNHMVKFLFR-ATVHPVEESA-NSynonyms
4(5((1Z)2CYANO3((3METHYLPHENYL)AMINO)3OXOPROP1EN1YL)FURAN2YL)3METHYLBENZOICACID
4(5((Z)2CYANO3(3METHYLANILINO)3OXOPROP1ENYL)FURAN2YL)3METHYLBENZOICACID
CC1=CC(=CC=C1)NC(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)C(=O)O)C)C#N
InChI=1SC23H18N2O4c11443518(1014)2522(26)17(1324)12197921(2919)208616(23(27)28)1115(20)2h312H12H3(H2526)(H2728)b1712
MFCD04528330
N#CC(=Cc1ccc(o1)c1ccc(cc1C)C(=O)O)C(=O)Nc1cccc(c1)C
STK081287
ZINC000004671862
ZINC4671862
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