Vitas-M small molecule compound
(2Z)-2-(furan-2-ylmethylidene)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK850933
SMILES CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccco1)/C2=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 C19H20N2O4 MW 340.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4/c1-20-6-8-21(9-7-20)12-15-16(22)5-4-14-18(23)17(25-19(14)15)11-13-3-2-10-24-13/h2-5,10-11,22H,6-9,12H2,1H3/b17-11-InChIKey
VDEDKMULYVMFRJ-BOPFTXTBSA-NSynonyms
896824-26-3(2Z)2(FURAN2YLMETHYLIDENE)6HYDROXY7((4METHYLPIPERAZIN1YL)METHYL)1BENZOFURAN3ONE
(2Z)2(furan2ylmethylidene)7((4methylpiperazin1ium1yl)methyl)3oxo23dihydro1benzofuran6olate
2(2FURYLMETHYLENE)6HYDROXY7((4METHYLPIPERAZINYL)METHYL)BENZO(B)FURAN3ONE
896824263
CN1CC(NH+)(CC1)Cc1c((O))ccc2c1OC(=Cc1ccco1)C2=O
CN1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=CC=CO4)C3=O)O
InChI=1SC19H20N2O4c1206821(9720)121516(22)541418(23)17(2519(14)15)111332102413h25101122H6912H21H3b1711
MFCD06598217
ZINC000020517822
ZINC20517822
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