Vitas-M small molecule compound

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

Catalog ID
STK507371
SMILES CCc1cccc(c1n1nnnc1C(Nc1ccccc1OC)(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 C21H27N5O MW 365.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O/c1-6-16-12-10-11-15(3)19(16)26-20(23-24-25-26)21(4,7-2)22-17-13-8-9-14-18(17)27-5/h8-14,22H,6-7H2,1-5H3
InChIKey
BNDOAFTZQSEZRO-UHFFFAOYSA-N
Synonyms

CCC1=CC=CC(=C1N2C(=NN=N2)C(C)(CC)NC3=CC=CC=C3OC)C
InChI=1SC21H27N5Oc161612101115(3)19(16)2620(23242526)21(472)221713891418(17)275h81422H67H215H3
MFCD13369303
N(2(1(2ethyl6methylphenyl)1Htetrazol5yl)butan2yl)2methoxyaniline
N(2(1(2ethyl6methylphenyl)tetrazol5yl)butan2yl)2methoxyaniline
ZINC000035622255
ZINC000035622257

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Available files

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