Vitas-M small molecule compound

N-{2-[1-(2-ethyl-6-methylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-2-methylaniline

Catalog ID
STK507666
SMILES CCc1cccc(c1n1nnnc1C(Nc1ccccc1C)(CC)C)C

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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 C21H27N5 MW 349.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5/c1-6-17-13-10-12-16(4)19(17)26-20(23-24-25-26)21(5,7-2)22-18-14-9-8-11-15(18)3/h8-14,22H,6-7H2,1-5H3
InChIKey
MLABQUMZXAHDCA-UHFFFAOYSA-N
Synonyms

CCC1=CC=CC(=C1N2C(=NN=N2)C(C)(CC)NC3=CC=CC=C3C)C
InChI=1SC21H27N5c161713101216(4)19(17)2620(23242526)21(572)221814981115(18)3h81422H67H215H3
MFCD00368242
N(2(1(2ethyl6methylphenyl)1Htetrazol5yl)butan2yl)2methylaniline
N(2(1(2ethyl6methylphenyl)tetrazol5yl)butan2yl)2methylaniline
ZINC000035622580
ZINC000035622582

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Available files

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