Vitas-M small molecule compound

N-{1-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]cyclohexyl}-2,3-dihydro-1,4-benzodioxin-6-amine

Catalog ID
STK507661
SMILES Clc1ccc(cc1)n1nnnc1C1(CCCCC1)Nc1ccc2c(c1)OCCO2

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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 C21H22ClN5O2 MW 411.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O2/c22-15-4-7-17(8-5-15)27-20(24-25-26-27)21(10-2-1-3-11-21)23-16-6-9-18-19(14-16)29-13-12-28-18/h4-9,14,23H,1-3,10-13H2
InChIKey
IYKXGNWHEPABED-UHFFFAOYSA-N
Synonyms

C1CCC(CC1)(C2=NN=NN2C3=CC=C(C=C3)Cl)NC4=CC5=C(C=C4)OCCO5
InChI=1SC21H22ClN5O2c22154717(8515)2720(24252627)21(102131121)2316691819(1416)2913122818h491423H131013H2
MFCD13369584
N(1(1(4chlorophenyl)1Htetrazol5yl)cyclohexyl)23dihydro14benzodioxin6amine
N(1(1(4chlorophenyl)tetrazol5yl)cyclohexyl)23dihydro14benzodioxin6amine
ZINC000035622568
ZINC35622568

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Available files

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