Vitas-M small molecule compound
(2E)-3-(3-bromo-4-butoxy-5-methoxyphenyl)-2-cyano-N-propylprop-2-enamide
Catalog ID
STK077804
SMILES CCCCOc1c(Br)cc(cc1OC)/C=C(/C(=O)NCCC)\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 C18H23BrN2O3 MW 395.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23BrN2O3/c1-4-6-8-24-17-15(19)10-13(11-16(17)23-3)9-14(12-20)18(22)21-7-5-2/h9-11H,4-8H2,1-3H3,(H,21,22)/b14-9+InChIKey
MDBBBNSCZVQLKP-NTEUORMPSA-NSynonyms
(2E)3(3BROMO4BUTOXY5METHOXYPHENYL)2CYANONPROPYLPROP2ENAMIDE
(E)3(3BROMO4BUTOXY5METHOXYPHENYL)2CYANONPROPYLPROP2ENAMIDE
CCCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NCCC)OC
CCCCOc1c(Br)cc(cc1OC)C=C(C(=O)NCCC)C#N
InChI=1SC18H23BrN2O3c1468241715(19)1013(1116(17)233)914(1220)18(22)21752h911H48H213H3(H2122)b149+
MFCD08671163
STK077804
ZINC000004670371
ZINC04670371
ZINC4670371
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