Vitas-M small molecule compound
1',6'-dimethyl-2,6-dioxo-1-(1-phenylethyl)-1,1',4',6-tetrahydro-2H,2'H-spiro[pyrimidine-5,3'-quinolinium]-4-olate
Catalog ID
STL565390
SMILES Cc1ccc2c(c1)CC1(C[NH+]2C)C(=NC(=O)N(C1=O)C(c1ccccc1)C)[O-]
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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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c1-14-9-10-18-17(11-14)12-22(13-24(18)3)19(26)23-21(28)25(20(22)27)15(2)16-7-5-4-6-8-16/h4-11,15H,12-13H2,1-3H3,(H,23,26,28)InChIKey
XDGXVRUBBCIVRT-UHFFFAOYSA-NSynonyms
859861-97-516dimethyl1(1phenylethyl)spiro(13diazinane5324dihydroquinoline)246trione
16dimethyl26dioxo1(1phenylethyl)1146tetrahydro2H2Hspiro(pyrimidine53quinolinium)4olate
4978956
859861975
InChI=1SC22H23N3O3c1149101817(1114)1222(1324(18)3)19(26)2321(28)25(20(22)27)15(2)167546816h41115H1213H213H3(H232628)
MFCD32651654
ZINC000009360337
ZINC000017209181
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