Vitas-M small molecule compound

N-{(1Z)-3-(butylamino)-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide

Catalog ID
STK836225
SMILES CCCCNC(=O)/C(=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(cc1)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 C25H25N3O6 MW 463.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O6/c1-3-4-14-26-25(30)22(27-24(29)17-8-10-20(33-2)11-9-17)16-21-12-13-23(34-21)18-6-5-7-19(15-18)28(31)32/h5-13,15-16H,3-4,14H2,1-2H3,(H,26,30)(H,27,29)/b22-16-
InChIKey
NHECPZFKDZGKQT-JWGURIENSA-N
Synonyms
374104-71-9
(2Z)NBUTYL2((4METHOXYPHENYL)CARBONYLAMINO)3(5(3NITROPHENYL)(2FURYL))PROP2ENAMIDE
(Z)N(3(butylamino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methoxybenzamide
374104719
CCCCNC(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)(N+)(=O)(O))NC(=O)C3=CC=C(C=C3)OC
CCCCNC(=O)C(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))NC(=O)c1ccc(cc1)OC
InChI=1SC25H25N3O6c134142625(30)22(2724(29)1781020(332)11917)1621121323(3421)1865719(1518)28(31)32h5131516H3414H212H3(H2630)(H2729)b2216
MFCD01953403
N((1Z)3(butylamino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methoxybenzamide
N((Z)3(BUTYLAMINO)1(5(3NITROPHENYL)FURAN2YL)3OXOPROP1EN2YL)4METHOXYBENZAMIDE
ZINC000002286436
ZINC02286436
ZINC2286436

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Available files

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