Vitas-M small molecule compound
2-chloro-5-(5-{(1E)-2-cyano-3-[(3-ethoxyphenyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK186455
SMILES CCOc1cccc(c1)NC(=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 C23H17ClN2O5 MW 436.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN2O5/c1-2-30-17-5-3-4-16(12-17)26-22(27)15(13-25)10-18-7-9-21(31-18)14-6-8-20(24)19(11-14)23(28)29/h3-12H,2H2,1H3,(H,26,27)(H,28,29)/b15-10+InChIKey
OTKIHHDDTNZOBF-XNTDXEJSSA-NSynonyms
(E)2chloro5(5(2cyano3((3ethoxyphenyl)amino)3oxoprop1en1yl)furan2yl)benzoicacid
2CHLORO5(5((1E)2CYANO3((3ETHOXYPHENYL)AMINO)3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
2CHLORO5(5((E)2CYANO3(3ETHOXYANILINO)3OXOPROP1ENYL)FURAN2YL)BENZOICACID
5(5((1E)2CYANO2(N(3ETHOXYPHENYL)CARBAMOYL)VINYL)(2FURYL))2CHLOROBENZOICACID
CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O)C#N
CCOc1cccc(c1)NC(=O)C(=Cc1ccc(o1)c1ccc(c(c1)C(=O)O)Cl)C#N
InChI=1SC23H17ClN2O5c12301753416(1217)2622(27)15(1325)10187921(3118)146820(24)19(1114)23(28)29h312H2H21H3(H2627)(H2829)b1510+
MFCD02194766
ZINC000008893226
ZINC8893226
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Check stock on Vitas-MAvailable files
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