Vitas-M small molecule compound
N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-[(2E)-2-{[5-(2,4,5-trichlorophenyl)furan-2-yl]methylidene}hydrazinyl]prop-1-en-2-yl}benzamide
Catalog ID
STK086237
SMILES O=C(/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)N/N=C/c1ccc(o1)c1cc(Cl)c(cc1Cl)Cl
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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 C28H18Cl3N3O5 MW 582.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18Cl3N3O5/c29-20-13-22(31)21(30)12-19(20)24-9-7-18(39-24)14-32-34-28(36)23(33-27(35)17-4-2-1-3-5-17)10-16-6-8-25-26(11-16)38-15-37-25/h1-14H,15H2,(H,33,35)(H,34,36)/b23-10+,32-14+InChIKey
QWBOVNGLICCAIT-ZLEQYAOTSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NN=CC3=CC=C(O3)C4=CC(=C(C=C4Cl)Cl)Cl)NC(=O)C5=CC=CC=C5
InChI=1SC28H18Cl3N3O5c29201322(31)21(30)1219(20)249718(3924)14323428(36)23(3327(35)174213517)1016682526(1116)38153725h114H15H2(H3335)(H3436)b2310+3214+
MFCD01146933
N((1E)1(13BENZODIOXOL5YL)3OXO3((2E)2((5(245TRICHLOROPHENYL)FURAN2YL)METHYLIDENE)HYDRAZINYL)PROP1EN2YL)BENZAMIDE
N((E)1(13benzodioxol5yl)3oxo3((2E)2((5(245trichlorophenyl)furan2yl)methylidene)hydrazinyl)prop1en2yl)benzamide
O=C(C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccccc1)NN=Cc1ccc(o1)c1cc(Cl)c(cc1Cl)Cl
STK086237
ZINC000097959139
ZINC101488656
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.