Vitas-M small molecule compound

3-(5-{(1Z)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)-4-methylbenzoic acid

Catalog ID
STK185301
SMILES N#C/C(=C/c1ccc(o1)c1cc(ccc1C)C(=O)O)/C(=O)Nc1ccc(cc1)OC

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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 C23H18N2O5 MW 402.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O5/c1-14-3-4-15(23(27)28)12-20(14)21-10-9-19(30-21)11-16(13-24)22(26)25-17-5-7-18(29-2)8-6-17/h3-12H,1-2H3,(H,25,26)(H,27,28)/b16-11-
InChIKey
WEUGUDPVSFTVIT-WJDWOHSUSA-N
Synonyms

3(5((1Z)2CYANO3((4METHOXYPHENYL)AMINO)3OXOPROP1EN1YL)FURAN2YL)4METHYLBENZOICACID
3(5((Z)2CYANO3(4METHOXYANILINO)3OXOPROP1ENYL)FURAN2YL)4METHYLBENZOICACID
3(5(2CYANO2(4METHOXYPHENYLCARBAMOYL)VINYL)FURAN2YL)4METHYLBENZOIC
3(5(2CYANO2(4METHOXYPHENYLCARBAMOYL)VINYL)FURAN2YL)4METHYLBENZOICACID
CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC23H18N2O5c1143415(23(27)28)1220(14)2110919(3021)1116(1324)22(26)25175718(292)8617h312H12H3(H2526)(H2728)b1611
MFCD02226392
N#CC(=Cc1ccc(o1)c1cc(ccc1C)C(=O)O)C(=O)Nc1ccc(cc1)OC
ZINC000038197705
ZINC38197705

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Available files

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