Vitas-M small molecule compound
ethyl 2-({(2E)-2-cyano-3-[2-(propan-2-yloxy)phenyl]prop-2-enoyl}amino)benzoate
Catalog ID
STK949880
SMILES CCOC(=O)c1ccccc1NC(=O)/C(=C/c1ccccc1OC(C)C)/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 C22H22N2O4 MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O4/c1-4-27-22(26)18-10-6-7-11-19(18)24-21(25)17(14-23)13-16-9-5-8-12-20(16)28-15(2)3/h5-13,15H,4H2,1-3H3,(H,24,25)/b17-13+InChIKey
ROWOFWPOJXRPMY-GHRIWEEISA-NSynonyms
CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC=CC=C2OC(C)C)C#N
CCOC(=O)c1ccccc1NC(=O)C(=Cc1ccccc1OC(C)C)C#N
ethyl2(((2E)2cyano3(2(propan2yloxy)phenyl)prop2enoyl)amino)benzoate
ETHYL2(((E)2CYANO3(2PROPAN2YLOXYPHENYL)PROP2ENOYL)AMINO)BENZOATE
ETHYL2((2E)2CYANO3(2(METHYLETHOXY)PHENYL)PROP2ENOYLAMINO)BENZOATE
InChI=1SC22H22N2O4c142722(26)1810671119(18)2421(25)17(1423)13169581220(16)2815(2)3h51315H4H213H3(H2425)b1713+
MFCD02957103
ZINC000001453873
ZINC01453873
ZINC1453873
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