Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-(4-{[(4-methylphenyl)carbonyl]oxy}phenyl)prop-2-enoyl]amino}benzoate
Catalog ID
STK899487
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1ccccc1C(=O)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 C26H20N2O5 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O5/c1-17-7-11-19(12-8-17)25(30)33-21-13-9-18(10-14-21)15-20(16-27)24(29)28-23-6-4-3-5-22(23)26(31)32-2/h3-15H,1-2H3,(H,28,29)/b20-15+InChIKey
BDFMMGRBQXQDRX-HMMYKYKNSA-NSynonyms
4((1E)2CYANO2(N(2(METHOXYCARBONYL)PHENYL)CARBAMOYL)VINYL)PHENYL4METHYLBENZOATE
CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC26H20N2O5c11771119(12817)25(30)332113918(101421)1520(1627)24(29)2823643522(23)26(31)322h315H12H3(H2829)b2015+
methyl2(((2E)2cyano3(4(((4methylphenyl)carbonyl)oxy)phenyl)prop2enoyl)amino)benzoate
methyl2(((E)2cyano3(4(4methylbenzoyl)oxyphenyl)prop2enoyl)amino)benzoate
MFCD02364662
N#CC(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)C)C(=O)Nc1ccccc1C(=O)OC
ZINC000000948761
ZINC00948761
ZINC948761
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