Vitas-M small molecule compound

methyl (2E)-2-{[2-methyl-1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}hydrazinecarboxylate

Catalog ID
STK385746
SMILES COC(=O)N/N=C/c1c(C)n(c2c1cccc2)CCOc1ccccc1

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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 C20H21N3O3 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3/c1-15-18(14-21-22-20(24)25-2)17-10-6-7-11-19(17)23(15)12-13-26-16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3,(H,22,24)/b21-14+
InChIKey
ILAFOIJIJKLQJT-KGENOOAVSA-N
Synonyms

CC1=C(C2=CC=CC=C2N1CCOC3=CC=CC=C3)C=NNC(=O)OC
COC(=O)NN=Cc1c(C)n(c2c1cccc2)CCOc1ccccc1
InChI=1SC20H21N3O3c11518(14212220(24)252)1710671119(17)23(15)121326168435916h31114H1213H212H3(H2224)b2114+
METHYL(2E)2((2METHYL1(2PHENOXYETHYL)1HINDOL3YL)METHYLIDENE)HYDRAZINECARBOXYLATE
methylN((E)(2methyl1(2phenoxyethyl)indol3yl)methylideneamino)carbamate
MFCD03037561
N((1E)2(2METHYL1(2PHENOXYETHYL)INDOL3YL)1AZAVINYL)METHOXYCARBOXAMIDE
ZINC000004091855
ZINC35313960

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Available files

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