Vitas-M small molecule compound
ethyl N-{2-[1-(4-bromophenyl)-1H-tetrazol-5-yl]tricyclo[3.3.1.1~3,7~]dec-2-yl}glycinate
Catalog ID
STK507401
SMILES CCOC(=O)CNC1(C2CC3CC1CC(C2)C3)c1nnnn1c1ccc(cc1)Br
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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 C21H26BrN5O2 MW 460.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26BrN5O2/c1-2-29-19(28)12-23-21(15-8-13-7-14(10-15)11-16(21)9-13)20-24-25-26-27(20)18-5-3-17(22)4-6-18/h3-6,13-16,23H,2,7-12H2,1H3InChIKey
WDRTZGRUJSNZDB-UHFFFAOYSA-NSynonyms
CCOC(=O)CNC1(C2CC3CC(C2)CC1C3)C4=NN=NN4C5=CC=C(C=C5)Br
ethyl2((2(1(4bromophenyl)tetrazol5yl)2adamantyl)amino)acetate
ethylN(2(1(4bromophenyl)1Htetrazol5yl)tricyclo(3311~37~)dec2yl)glycinate
InChI=1SC21H26BrN5O2c122919(28)122321(15813714(1015)1116(21)913)2024252627(20)185317(22)4618h36131623H2712H21H3
MFCD13369332
ZINC000035622324
ZINC35622324
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