Vitas-M small molecule compound
2-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-{4-[2-(1H-tetrazol-5-yl)ethyl]phenyl}acetamide
Catalog ID
STL423000
SMILES COc1c(OC)ccc2c1C(=O)OC2CC(=O)Nc1ccc(cc1)CCc1nnn[nH]1
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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 C21H21N5O5 MW 423.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O5/c1-29-15-9-8-14-16(31-21(28)19(14)20(15)30-2)11-18(27)22-13-6-3-12(4-7-13)5-10-17-23-25-26-24-17/h3-4,6-9,16H,5,10-11H2,1-2H3,(H,22,27)(H,23,24,25,26)InChIKey
FFNAGFDPKUDYFQ-UHFFFAOYSA-NSynonyms
1676098-09-11676098091
2(45dimethoxy3oxo13dihydro2benzofuran1yl)N(4(2(1Htetrazol5yl)ethyl)phenyl)acetamide
2(45dimethoxy3oxo1H2benzofuran1yl)N(4(2(2Htetrazol5yl)ethyl)phenyl)acetamide
COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)NC3=CC=C(C=C3)CCC4=NNN=N4)OC
COc1c(OC)ccc2c1C(=O)OC2CC(=O)Nc1ccc(cc1)CCc1nnn(nH)1
InChI=1SC21H21N5O5c12915981416(3121(28)19(14)20(15)302)1118(27)22136312(4713)510172325262417h346916H51011H212H3(H2227)(H23242526)
MFCD28986441
N(4(2(1Htetrazol5yl)ethyl)phenyl)2(45dimethoxy3oxo13dihydroisobenzofuran1yl)acetamide
ZINC000218460259
ZINC000218460336
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