Vitas-M small molecule compound
{3-[(dimethylcarbamoyl)oxy]pyridin-2-yl}-N,N-dimethyl-N-{[(octahydro-1H-2,5-methanoinden-6-ylcarbonyl)oxy]methyl}methanaminium
Catalog ID
STK108513
SMILES CN(C(=O)Oc1cccnc1C[N+](COC(=O)C1CC2CC3CC1CC2C3)(C)C)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 C23H34N3O4 MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N3O4/c1-25(2)23(28)30-21-6-5-7-24-20(21)13-26(3,4)14-29-22(27)19-12-17-9-15-8-16(17)11-18(19)10-15/h5-7,15-19H,8-14H2,1-4H3/q+1InChIKey
BTUZUIDUPGWLIR-UHFFFAOYSA-NSynonyms
(3((DIMETHYLCARBAMOYL)OXY)PYRIDIN2YL)NNDIMETHYLN(((OCTAHYDRO1H25METHANOINDEN6YLCARBONYL)OXY)METHYL)METHANAMINIUM
1(3((dimethylcarbamoyl)oxy)pyridin2yl)NNdimethylN((((3aS5R7aR)octahydro1H25methanoindene6carbonyl)oxy)methyl)methanaminiumchloride
CN(C(=O)Oc1cccnc1C(N+)(COC(=O)C1CC2CC3CC1CC2C3)(C)C)C
CN(C(=O)Oc1cccnc1C(N+)(COC(=O)C1CC2CC3CC1CC2C3)(C)C)C(Cl)
CN(C)C(=O)OC1=C(N=CC=C1)C(N+)(C)(C)COC(=O)C2CC3CC4CC3CC2C4
InChI=1SC23H34N3O4c125(2)23(28)30216572420(21)1326(34)142922(27)191217915816(17)1118(19)1015h571519H814H214H3q+1
MFCD03289214
ZINC000102691994
ZINC000102692008
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