Vitas-M small molecule compound
2-chloro-5-{5-[(1E)-2-cyano-3-(methylamino)-3-oxoprop-1-en-1-yl]furan-2-yl}benzoic acid
Catalog ID
STK182298
SMILES CNC(=O)/C(=C/c1ccc(o1)c1ccc(c(c1)C(=O)O)Cl)/C#N
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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 C16H11ClN2O4 MW 330.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O4/c1-19-15(20)10(8-18)6-11-3-5-14(23-11)9-2-4-13(17)12(7-9)16(21)22/h2-7H,1H3,(H,19,20)(H,21,22)/b10-6+InChIKey
BQKIODVRZFKDTO-UXBLZVDNSA-NSynonyms
(E)2chloro5(5(2cyano3(methylamino)3oxoprop1en1yl)furan2yl)benzoicacid
2CHLORO5(5((1E)2CYANO3(METHYLAMINO)3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
2CHLORO5(5((E)2CYANO3(METHYLAMINO)3OXOPROP1ENYL)FURAN2YL)BENZOICACID
5(5((1E)2CYANO2(NMETHYLCARBAMOYL)VINYL)(2FURYL))2CHLOROBENZOICACID
CNC(=O)C(=CC1=CC=C(O1)C2=CC(=C(C=C2)Cl)C(=O)O)C#N
CNC(=O)C(=Cc1ccc(o1)c1ccc(c(c1)C(=O)O)Cl)C#N
InChI=1SC16H11ClN2O4c11915(20)10(818)6113514(2311)92413(17)12(79)16(21)22h27H1H3(H1920)(H2122)b106+
MFCD02316421
ZINC000004722737
ZINC4722737
Check stock
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