Vitas-M small molecule compound

N-{1-[1-(3,4-dimethoxyphenyl)-1H-tetrazol-5-yl]cyclohexyl}-2-methylaniline

Catalog ID
STK507676
SMILES COc1cc(ccc1OC)n1nnnc1C1(CCCCC1)Nc1ccccc1C

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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 C22H27N5O2 MW 393.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2/c1-16-9-5-6-10-18(16)23-22(13-7-4-8-14-22)21-24-25-26-27(21)17-11-12-19(28-2)20(15-17)29-3/h5-6,9-12,15,23H,4,7-8,13-14H2,1-3H3
InChIKey
OSRIDDKEVMVJFX-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1NC2(CCCCC2)C3=NN=NN3C4=CC(=C(C=C4)OC)OC
InChI=1SC22H27N5O2c1169561018(16)2322(137481422)2124252627(21)17111219(282)20(1517)293h569121523H4781314H213H3
MFCD13369595
N(1(1(34dimethoxyphenyl)1Htetrazol5yl)cyclohexyl)2methylaniline
N(1(1(34dimethoxyphenyl)tetrazol5yl)cyclohexyl)2methylaniline
ZINC000035622611
ZINC35622611

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Available files

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