Vitas-M small molecule compound

3-methyl-N'-{[(2E)-3-phenylprop-2-enoyl]oxy}benzenecarboximidamide

Catalog ID
STK061500
SMILES O=C(O/N=C(/c1cccc(c1)C)\N)/C=C/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 C17H16N2O2 MW 280.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2/c1-13-6-5-9-15(12-13)17(18)19-21-16(20)11-10-14-7-3-2-4-8-14/h2-12H,1H3,(H2,18,19)/b11-10+
InChIKey
STBQJENDORKKBP-ZHACJKMWSA-N
Synonyms

((E)(amino(3methylphenyl)methylidene)amino)(E)3phenylprop2enoate
3METHYLN(((2E)3PHENYLPROP2ENOYL)OXY)BENZENECARBOXIMIDAMIDE
CC1=CC=CC(=C1)C(=NOC(=O)C=CC2=CC=CC=C2)N
InChI=1SC17H16N2O2c11365915(1213)17(18)192116(20)1110147324814h212H1H3(H21819)b1110+
MFCD02047513
O=C(ON=C(c1cccc(c1)C)N)C=Cc1ccccc1
STK061500
ZINC000005942875
ZINC05942875
ZINC5942875

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Available files

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