Vitas-M small molecule compound

N-[(1E)-3-[(2E)-2-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}hydrazinyl]-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide

Catalog ID
STK379679
SMILES COc1cc(ccc1OC)/C=C(\C(=O)N/N=C/c1ccc(o1)c1cc(Cl)ccc1Cl)/NC(=O)c1ccccc1

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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 C29H23Cl2N3O5 MW 564.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23Cl2N3O5/c1-37-26-12-8-18(15-27(26)38-2)14-24(33-28(35)19-6-4-3-5-7-19)29(36)34-32-17-21-10-13-25(39-21)22-16-20(30)9-11-23(22)31/h3-17H,1-2H3,(H,33,35)(H,34,36)/b24-14+,32-17+
InChIKey
JMPFNOMKDPIMHX-IDPCLHLCSA-N
Synonyms

(2E)N((1E)2(5(25DICHLOROPHENYL)(2FURYL))1AZAVINYL)3(34DIMETHOXYPHENYL)2(PHENYLCARBONYLAMINO)PROP2ENAMIDE
COC1=C(C=C(C=C1)C=C(C(=O)NN=CC2=CC=C(O2)C3=C(C=CC(=C3)Cl)Cl)NC(=O)C4=CC=CC=C4)OC
COc1cc(ccc1OC)C=C(C(=O)NN=Cc1ccc(o1)c1cc(Cl)ccc1Cl)NC(=O)c1ccccc1
InChI=1SC29H23Cl2N3O5c1372612818(1527(26)382)1424(3328(35)196435719)29(36)34321721101325(3921)221620(30)91123(22)31h317H12H3(H3335)(H3436)b2414+3217+
MFCD02068067
N((1E)3((2E)2((5(25dichlorophenyl)furan2yl)methylidene)hydrazinyl)1(34dimethoxyphenyl)3oxoprop1en2yl)benzamide
N((E)3((2E)2((5(25dichlorophenyl)furan2yl)methylidene)hydrazinyl)1(34dimethoxyphenyl)3oxoprop1en2yl)benzamide
ZINC000097962947
ZINC102134863

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.