Vitas-M small molecule compound

(3E)-3-(2-{[(4-chloro-2,5-dimethoxyphenyl)amino](oxo)acetyl}hydrazinylidene)-N-(3-chloro-4-methoxyphenyl)butanamide

Catalog ID
STK118635
SMILES COc1cc(Cl)c(cc1NC(=O)C(=O)N/N=C(/CC(=O)Nc1ccc(c(c1)Cl)OC)\C)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 C21H22Cl2N4O6 MW 497.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N4O6/c1-11(7-19(28)24-12-5-6-16(31-2)13(22)8-12)26-27-21(30)20(29)25-15-10-17(32-3)14(23)9-18(15)33-4/h5-6,8-10H,7H2,1-4H3,(H,24,28)(H,25,29)(H,27,30)/b26-11+
InChIKey
MFIAUQNVGZRPFI-KBKYJPHKSA-N
Synonyms
370575-66-9
(3E)3(2(((4CHLORO25DIMETHOXYPHENYL)AMINO)(OXO)ACETYL)HYDRAZINYLIDENE)N(3CHLORO4METHOXYPHENYL)BUTANAMIDE
(E)3(2(2((4chloro25dimethoxyphenyl)amino)2oxoacetyl)hydrazono)N(3chloro4methoxyphenyl)butanamide
370575669
CC(=NNC(=O)C(=O)NC1=CC(=C(C=C1OC)Cl)OC)CC(=O)NC2=CC(=C(C=C2)OC)Cl
COc1cc(Cl)c(cc1NC(=O)C(=O)NN=C(CC(=O)Nc1ccc(c(c1)Cl)OC)C)OC
InChI=1SC21H22Cl2N4O6c111(719(28)24125616(312)13(22)812)262721(30)20(29)25151017(323)14(23)918(15)334h56810H7H214H3(H2428)(H2529)(H2730)b2611+
MFCD02012513
N(4chloro25dimethoxyphenyl)N((E)(4(3chloro4methoxyanilino)4oxobutan2ylidene)amino)oxamide
ZINC000100330841
ZINC100330844

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Available files

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