Vitas-M small molecule compound
N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-{(2E)-2-[3-(benzyloxy)benzylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Catalog ID
STK513881
SMILES O=C(/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)N/N=C/c1cccc(c1)OCc1ccccc1
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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 C31H25N3O5 MW 519.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N3O5/c35-30(25-11-5-2-6-12-25)33-27(17-23-14-15-28-29(18-23)39-21-38-28)31(36)34-32-19-24-10-7-13-26(16-24)37-20-22-8-3-1-4-9-22/h1-19H,20-21H2,(H,33,35)(H,34,36)/b27-17+,32-19+InChIKey
MYEGOTFKRJVTHS-PNSMRIQGSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NN=CC3=CC(=CC=C3)OCC4=CC=CC=C4)NC(=O)C5=CC=CC=C5
InChI=1SC31H25N3O5c3530(25115261225)3327(172314152829(1823)39213828)31(36)343219241071326(1624)3720228314922h119H2021H2(H3335)(H3436)b2717+3219+
MFCD01146922
N((1E)1(13benzodioxol5yl)3((2E)2(3(benzyloxy)benzylidene)hydrazinyl)3oxoprop1en2yl)benzamide
N((E)1(13benzodioxol5yl)3oxo3((2E)2((3phenylmethoxyphenyl)methylidene)hydrazinyl)prop1en2yl)benzamide
O=C(C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccccc1)NN=Cc1cccc(c1)OCc1ccccc1
ZINC000036235377
ZINC98021068
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