Vitas-M small molecule compound
methyl 2-(5-{2-[(2-ethoxy-2-oxoethyl)amino]tricyclo[3.3.1.1~3,7~]dec-2-yl}-1H-tetrazol-1-yl)benzoate
Catalog ID
STK507449
SMILES CCOC(=O)CNC1(C2CC3CC1CC(C2)C3)c1nnnn1c1ccccc1C(=O)OC
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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 C23H29N5O4 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O4/c1-3-32-20(29)13-24-23(16-9-14-8-15(11-16)12-17(23)10-14)22-25-26-27-28(22)19-7-5-4-6-18(19)21(30)31-2/h4-7,14-17,24H,3,8-13H2,1-2H3InChIKey
ZSBXPJJZVSXWSE-UHFFFAOYSA-NSynonyms
CCOC(=O)CNC1(C2CC3CC(C2)CC1C3)C4=NN=NN4C5=CC=CC=C5C(=O)OC
InChI=1SC23H29N5O4c133220(29)132423(16914815(1116)1217(23)1014)2225262728(22)19754618(19)21(30)312h47141724H3813H212H3
methyl2(5(2((2ethoxy2oxoethyl)amino)2adamantyl)tetrazol1yl)benzoate
methyl2(5(2((2ethoxy2oxoethyl)amino)tricyclo(3311~37~)dec2yl)1Htetrazol1yl)benzoate
MFCD13369380
ZINC000035606493
ZINC35606493
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