Vitas-M small molecule compound
4-{[(4E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino}benzamide
Catalog ID
STL471107
SMILES COc1c(C/C=C(/CCC(=O)Nc2ccc(cc2)C(=O)N)\C)c(OC)c2c(c1C)COC2=O
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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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-14(6-12-20(28)27-17-9-7-16(8-10-17)24(26)29)5-11-18-22(31-3)15(2)19-13-33-25(30)21(19)23(18)32-4/h5,7-10H,6,11-13H2,1-4H3,(H2,26,29)(H,27,28)/b14-5+InChIKey
GEKAAJZYPKDSIX-LHHJGKSTSA-NSynonyms
1282457-85-5(E)4(6(46dimethoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylhex4enamido)benzamide
1282457855
4(((4E)6(46dimethoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enoyl)amino)benzamide
4(((E)6(46dimethoxy7methyl3oxo1H2benzofuran5yl)4methylhex4enoyl)amino)benzamide
CC1=C(C(=C(C2=C1COC2=O)OC)CC=C(C)CCC(=O)NC3=CC=C(C=C3)C(=O)N)OC
COc1c(CC=C(CCC(=O)Nc2ccc(cc2)C(=O)N)C)c(OC)c2c(c1C)COC2=O
InChI=1SC25H28N2O6c114(61220(28)27179716(81017)24(26)29)5111822(313)15(2)19133325(30)21(19)23(18)324h5710H61113H214H3(H22629)(H2728)b145+
MFCD18791113
ZINC000062001741
ZINC62001741
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