Vitas-M small molecule compound
1,3-dimethyl-2,6-dioxo-5-(2,3,3-trimethyl-1,2,3,4-tetrahydroisoquinolinium-1-yl)-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STL527022
SMILES [O-]c1c(c(=O)n(c(=O)n1C)C)C1c2ccccc2CC([NH+]1C)(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 C18H23N3O3 MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3/c1-18(2)10-11-8-6-7-9-12(11)14(21(18)5)13-15(22)19(3)17(24)20(4)16(13)23/h6-9,14,22H,10H2,1-5H3InChIKey
XLOYQRFIVDDJAX-UHFFFAOYSA-NSynonyms
(O)c1c(c(=O)n(c(=O)n1C)C)C1c2ccccc2CC((NH+)1C)(C)C
13dimethyl26dioxo5(233trimethyl1234tetrahydroisoquinolin2ium1yl)1236tetrahydropyrimidin4olate
13dimethyl26dioxo5(233trimethyl1234tetrahydroisoquinolinium1yl)1236tetrahydropyrimidin4olate
13dimethyl26dioxo5(233trimethyl24dihydro1~(H)isoquinolin2ium1yl)pyrimidin4olate
13DIMETHYL26DIOXO5(233TRIMETHYL24DIHYDRO1HISOQUINOLIN2IUM1YL)PYRIMIDIN4OLATE
3730866
InChI=1SC18H23N3O3c118(2)1011867912(11)14(21(18)5)1315(22)19(3)17(24)20(4)16(13)23h691422H10H215H3
ZINC000020113110
ZINC000020113113
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