Vitas-M small molecule compound
4-{(1Z)-3-[(4-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-ethoxyphenyl acetate
Catalog ID
STK379315
SMILES CCOc1cc(ccc1OC(=O)C)/C=C(\C(=O)Nc1ccc(cc1)Br)/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 C20H17BrN2O4 MW 429.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN2O4/c1-3-26-19-11-14(4-9-18(19)27-13(2)24)10-15(12-22)20(25)23-17-7-5-16(21)6-8-17/h4-11H,3H2,1-2H3,(H,23,25)/b15-10-InChIKey
VWXIEFKZRLEPBO-GDNBJRDFSA-NSynonyms
(4((Z)3(4bromoanilino)2cyano3oxoprop1enyl)2ethoxyphenyl)acetate
4((1Z)3((4bromophenyl)amino)2cyano3oxoprop1en1yl)2ethoxyphenylacetate
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)Br)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=C(C(=O)Nc1ccc(cc1)Br)C#N
InChI=1SC20H17BrN2O4c1326191114(4918(19)2713(2)24)1015(1222)20(25)23177516(21)6817h411H3H212H3(H2325)b1510
MFCD02067918
ZINC000016157795
ZINC16157795
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