Vitas-M small molecule compound

(3E)-3-{2-[(2-bromo-4-chlorophenoxy)acetyl]hydrazinylidene}-N-(3-phenylpropyl)butanamide

Catalog ID
STK109797
SMILES O=C(C/C(=N/NC(=O)COc1ccc(cc1Br)Cl)/C)NCCCc1ccccc1

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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 C21H23BrClN3O3 MW 480.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrClN3O3/c1-15(12-20(27)24-11-5-8-16-6-3-2-4-7-16)25-26-21(28)14-29-19-10-9-17(23)13-18(19)22/h2-4,6-7,9-10,13H,5,8,11-12,14H2,1H3,(H,24,27)(H,26,28)/b25-15+
InChIKey
CSWMRNMBPGTVIM-MFKUBSTISA-N
Synonyms

(3E)3((2(2bromo4chlorophenoxy)acetyl)hydrazinylidene)N(3phenylpropyl)butanamide
(3E)3(2((2BROMO4CHLOROPHENOXY)ACETYL)HYDRAZINYLIDENE)N(3PHENYLPROPYL)BUTANAMIDE
CC(=NNC(=O)COC1=C(C=C(C=C1)Cl)Br)CC(=O)NCCCC2=CC=CC=C2
InChI=1SC21H23BrClN3O3c115(1220(27)241158166324716)252621(28)14291910917(23)1318(19)22h246791013H58111214H21H3(H2427)(H2628)b2515+
MFCD03238441
O=C(CC(=NNC(=O)COc1ccc(cc1Br)Cl)C)NCCCc1ccccc1
ZINC000101513988
ZINC101513989

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Available files

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