Vitas-M small molecule compound

butyl 4-{[(2E)-2-cyano-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino}benzoate

Catalog ID
STK949399
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccc(o1)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 C25H22N2O4 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4/c1-2-3-15-30-25(29)19-9-11-21(12-10-19)27-24(28)20(17-26)16-22-13-14-23(31-22)18-7-5-4-6-8-18/h4-14,16H,2-3,15H2,1H3,(H,27,28)/b20-16+
InChIKey
BZKRQOLRGNODRM-CAPFRKAQSA-N
Synonyms

butyl4(((2E)2cyano3(5phenylfuran2yl)prop2enoyl)amino)benzoate
BUTYL4(((E)2CYANO3(5PHENYLFURAN2YL)PROP2ENOYL)AMINO)BENZOATE
BUTYL4((2E)2CYANO3(5PHENYL(2FURYL))PROP2ENOYLAMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC=CC=C3)C#N
CCCCOC(=O)c1ccc(cc1)NC(=O)C(=Cc1ccc(o1)c1ccccc1)C#N
InChI=1SC25H22N2O4c123153025(29)1991121(121019)2724(28)20(1726)1622131423(3122)187546818h41416H2315H21H3(H2728)b2016+
MFCD02354068
ZINC000002669535
ZINC02669535
ZINC2669535

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Available files

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