Vitas-M small molecule compound
8-ethyl-5-oxo-2-[4-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)piperazin-1-ium-1-yl]-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK561210
SMILES CCn1cc(C(=O)[O-])c(=O)c2c1nc(nc2)[NH+]1CCN(CC1)C(=S)NC12CC3CC(C2)CC(C1)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 C25H32N6O3S MW 496.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N6O3S/c1-2-29-14-19(22(33)34)20(32)18-13-26-23(27-21(18)29)30-3-5-31(6-4-30)24(35)28-25-10-15-7-16(11-25)9-17(8-15)12-25/h13-17H,2-12H2,1H3,(H,28,35)(H,33,34)InChIKey
JQVLDPQACVIIIX-UHFFFAOYSA-NSynonyms
579444-18-18ethyl5oxo2(4(tricyclo(3311~37~)dec1ylcarbamothioyl)piperazin1ium1yl)58dihydropyrido(23d)pyrimidine6carboxylate
CCn1cc(C(=O)(O))c(=O)c2c1nc(nc2)(NH+)1CCN(CC1)C(=S)NC12CC3CC(C2)CC(C1)C3
MFCD03820270
ZINC000009191228
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