Vitas-M small molecule compound
butyl 4-{[(2E)-2-cyano-3-phenylprop-2-enoyl]amino}benzoate
Catalog ID
STK391713
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccccc1)/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 C21H20N2O3 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3/c1-2-3-13-26-21(25)17-9-11-19(12-10-17)23-20(24)18(15-22)14-16-7-5-4-6-8-16/h4-12,14H,2-3,13H2,1H3,(H,23,24)/b18-14+InChIKey
BNZKSDCMCXUPBH-NBVRZTHBSA-NSynonyms
butyl4(((2E)2cyano3phenylprop2enoyl)amino)benzoate
BUTYL4(((E)2CYANO3PHENYLPROP2ENOYL)AMINO)BENZOATE
BUTYL4((2E)2CYANO3PHENYLPROP2ENOYLAMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CC=C2)C#N
CCCCOC(=O)c1ccc(cc1)NC(=O)C(=Cc1ccccc1)C#N
InChI=1SC21H20N2O3c123132621(25)1791119(121017)2320(24)18(1522)14167546816h41214H2313H21H3(H2324)b1814+
MFCD02351055
ZINC000002669869
ZINC02669869
ZINC2669869
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