Vitas-M small molecule compound
methyl 3-{5-[2-(methylamino)tricyclo[3.3.1.1~3,7~]dec-2-yl]-1H-tetrazol-1-yl}benzoate
Catalog ID
STK507712
SMILES COC(=O)c1cccc(c1)n1nnnc1C1(NC)C2CC3CC1CC(C2)C3
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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 C20H25N5O2 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2/c1-21-20(15-7-12-6-13(9-15)10-16(20)8-12)19-22-23-24-25(19)17-5-3-4-14(11-17)18(26)27-2/h3-5,11-13,15-16,21H,6-10H2,1-2H3InChIKey
SAZOQZFYYHFPCE-UHFFFAOYSA-NSynonyms
CNC1(C2CC3CC(C2)CC1C3)C4=NN=NN4C5=CC=CC(=C5)C(=O)OC
InChI=1SC20H25N5O2c12120(15712613(915)1016(20)812)1922232425(19)1753414(1117)18(26)272h351113151621H610H212H3
methyl3(5(2(methylamino)2adamantyl)tetrazol1yl)benzoate
methyl3(5(2(methylamino)tricyclo(3311~37~)dec2yl)1Htetrazol1yl)benzoate
MFCD13369631
ZINC000035622666
ZINC35622666
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