Vitas-M small molecule compound
ethyl 4-[(4E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]piperazine-1-carboxylate
Catalog ID
STL521626
SMILES CCOC(=O)N1CCN(CC1)C(=O)CC/C(=C/Cc1c(OC)c(C)c2c(c1OC)C(=O)OC2)/C
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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 C25H34N2O7 MW 474.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N2O7/c1-6-33-25(30)27-13-11-26(12-14-27)20(28)10-8-16(2)7-9-18-22(31-4)17(3)19-15-34-24(29)21(19)23(18)32-5/h7H,6,8-15H2,1-5H3/b16-7+InChIKey
HMDFWCKCLAYECO-FRKPEAEDSA-NSynonyms
1574537-23-7(E)ETHYL4(6(46DIMETHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)4METHYLHEX4ENOYL)PIPERAZINE1CARBOXYLATE
1574537237
75464633
CCOC(=O)N1CCN(CC1)C(=O)CCC(=CCc1c(OC)c(C)c2c(c1OC)C(=O)OC2)C
ethyl4((~(E))6(46dimethoxy7methyl3oxo1~(H)2benzofuran5yl)4methylhex4enoyl)piperazine1carboxylate
ethyl4((4E)6(46dimethoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enoyl)piperazine1carboxylate
InChI=1SC25H34N2O7c163325(30)27131126(121427)20(28)10816(2)791822(314)17(3)19153424(29)21(19)23(18)325h7H6815H215H3b167+
MFCD28050587
ZINC000096113744
ZINC96113744
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