Vitas-M small molecule compound
ethyl 4-({(2E)-2-cyano-3-[3-methoxy-4-(pentyloxy)phenyl]prop-2-enoyl}amino)benzoate
Catalog ID
STK949939
SMILES CCCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1ccc(cc1)C(=O)OCC)\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 C25H28N2O5 MW 436.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O5/c1-4-6-7-14-32-22-13-8-18(16-23(22)30-3)15-20(17-26)24(28)27-21-11-9-19(10-12-21)25(29)31-5-2/h8-13,15-16H,4-7,14H2,1-3H3,(H,27,28)/b20-15+InChIKey
LLEFENWYPQYMMJ-HMMYKYKNSA-NSynonyms
CCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)OCC)OC
CCCCCOc1ccc(cc1OC)C=C(C(=O)Nc1ccc(cc1)C(=O)OCC)C#N
ethyl4(((2E)2cyano3(3methoxy4(pentyloxy)phenyl)prop2enoyl)amino)benzoate
ETHYL4(((E)2CYANO3(3METHOXY4PENTOXYPHENYL)PROP2ENOYL)AMINO)BENZOATE
ETHYL4((2E)2CYANO3(3METHOXY4PENTYLOXYPHENYL)PROP2ENOYLAMINO)BENZOATE
InChI=1SC25H28N2O5c146714322213818(1623(22)303)1520(1726)24(28)272111919(101221)25(29)3152h8131516H4714H213H3(H2728)b2015+
MFCD02957138
ZINC000012124815
ZINC12124815
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