Vitas-M small molecule compound
(2Z)-6-[2-(4-benzylpiperazin-1-yl)ethoxy]-2-(4-methoxybenzylidene)-1-benzofuran-3(2H)-one
Catalog ID
STL033951
SMILES COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCCN1CCN(CC1)Cc1ccccc1
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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 C29H30N2O4 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O4/c1-33-24-9-7-22(8-10-24)19-28-29(32)26-12-11-25(20-27(26)35-28)34-18-17-30-13-15-31(16-14-30)21-23-5-3-2-4-6-23/h2-12,19-20H,13-18,21H2,1H3/b28-19-InChIKey
HCVKBGRIJKPBLW-USHMODERSA-NSynonyms
(2Z)6(2(4benzylpiperazin1yl)ethoxy)2((4methoxyphenyl)methylidene)1benzofuran3one
(2Z)6(2(4benzylpiperazin1yl)ethoxy)2(4methoxybenzylidene)1benzofuran3(2H)one
2((4METHOXYPHENYL)METHYLENE)6(2(4BENZYLPIPERAZINYL)ETHOXY)BENZO(B)FURAN3ONE
COC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCCN4CCN(CC4)CC5=CC=CC=C5
COc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OCCN1CCN(CC1)Cc1ccccc1
InChI=1SC29H30N2O4c133249722(81024)192829(32)26121125(2027(26)3528)34181730131531(161430)21235324623h2121920H131821H21H3b2819
MFCD07808361
ZINC000022854522
ZINC22854522
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