Vitas-M small molecule compound
N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-[(2E)-2-(3,4,5-trimethoxybenzylidene)hydrazinyl]prop-1-en-2-yl}benzamide
Catalog ID
STK513847
SMILES COc1cc(/C=N/NC(=O)/C(=C\c2ccc3c(c2)OCO3)/NC(=O)c2ccccc2)cc(c1OC)OC
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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 C27H25N3O7 MW 503.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O7/c1-33-23-13-18(14-24(34-2)25(23)35-3)15-28-30-27(32)20(29-26(31)19-7-5-4-6-8-19)11-17-9-10-21-22(12-17)37-16-36-21/h4-15H,16H2,1-3H3,(H,29,31)(H,30,32)/b20-11+,28-15+InChIKey
ZPJDEIACKFNQCX-XBNGYGLISA-NSynonyms
COC1=CC(=CC(=C1OC)OC)C=NNC(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=C4
COc1cc(C=NNC(=O)C(=Cc2ccc3c(c2)OCO3)NC(=O)c2ccccc2)cc(c1OC)OC
InChI=1SC27H25N3O7c133231318(1424(342)25(23)353)15283027(32)20(2926(31)197546819)11179102122(1217)37163621h415H16H213H3(H2931)(H3032)b2011+2815+
MFCD00471900
N((1E)1(13benzodioxol5yl)3oxo3((2E)2(345trimethoxybenzylidene)hydrazinyl)prop1en2yl)benzamide
N((E)1(13benzodioxol5yl)3oxo3((2E)2((345trimethoxyphenyl)methylidene)hydrazinyl)prop1en2yl)benzamide
ZINC000036235340
ZINC98021039
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