Vitas-M small molecule compound

N-(1-{1-[4-(propan-2-yl)phenyl]-1H-tetrazol-5-yl}cyclohexyl)aniline

Catalog ID
STK507806
SMILES CC(c1ccc(cc1)n1nnnc1C1(CCCCC1)Nc1ccccc1)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 C22H27N5 MW 361.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5/c1-17(2)18-11-13-20(14-12-18)27-21(24-25-26-27)22(15-7-4-8-16-22)23-19-9-5-3-6-10-19/h3,5-6,9-14,17,23H,4,7-8,15-16H2,1-2H3
InChIKey
CXEAFYOANVQXIM-UHFFFAOYSA-N
Synonyms

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)C3(CCCCC3)NC4=CC=CC=C4
InChI=1SC22H27N5c117(2)18111320(141218)2721(24252627)22(157481622)231995361019h3569141723H4781516H212H3
MFCD13369725
N(1(1(4(propan2yl)phenyl)1Htetrazol5yl)cyclohexyl)aniline
N(1(1(4propan2ylphenyl)tetrazol5yl)cyclohexyl)aniline
ZINC000035622677
ZINC35622677

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Available files

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