Vitas-M small molecule compound

3-({1-[1-(2-methylphenyl)-1H-tetrazol-5-yl]cyclopentyl}amino)benzoic acid

Catalog ID
STK093578
SMILES Cc1ccccc1n1nnnc1C1(CCCC1)Nc1cccc(c1)C(=O)O

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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 C20H21N5O2 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2/c1-14-7-2-3-10-17(14)25-19(22-23-24-25)20(11-4-5-12-20)21-16-9-6-8-15(13-16)18(26)27/h2-3,6-10,13,21H,4-5,11-12H2,1H3,(H,26,27)
InChIKey
MOGLEBGEJCHLBB-UHFFFAOYSA-N
Synonyms

3((1(1(2METHYLPHENYL)1HTETRAZOL5YL)CYCLOPENTYL)AMINO)BENZOICACID
3((1(1(2METHYLPHENYL)TETRAZOL5YL)CYCLOPENTYL)AMINO)BENZOICACID
CC1=CC=CC=C1N2C(=NN=N2)C3(CCCC3)NC4=CC=CC(=C4)C(=O)O
Cc1ccccc1n1nnnc1C1(CCCC1)Nc1cccc(c1)C(=O)O
InChI=1SC20H21N5O2c1147231017(14)2519(22232425)20(11451220)211696815(1316)18(26)27h236101321H451112H21H3(H2627)
MFCD00355351
STK093578
ZINC000004663565
ZINC4663565

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Available files

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