Vitas-M small molecule compound
1-butyl-1',6'-dimethyl-2,6-dioxo-1,1',4',6-tetrahydro-2H,2'H-spiro[pyrimidine-5,3'-quinolinium]-4-olate
Catalog ID
STK569679
SMILES CCCCN1C(=O)N=C(C2(C1=O)C[NH+](C)c1c(C2)cc(cc1)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 C18H23N3O3 MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3/c1-4-5-8-21-16(23)18(15(22)19-17(21)24)10-13-9-12(2)6-7-14(13)20(3)11-18/h6-7,9H,4-5,8,10-11H2,1-3H3,(H,19,22,24)InChIKey
FGOYTGPFURHLSP-UHFFFAOYSA-NSynonyms
849005-47-6(5R)1BUTYL16DIMETHYL14DIHYDRO2H2HSPIRO(PYRIMIDINE53QUINOLINE)246(1H3H)TRIONE
(5S)1BUTYL16DIMETHYL14DIHYDRO2H2HSPIRO(PYRIMIDINE53QUINOLINE)246(1H3H)TRIONE
1butyl16dimethyl26dioxo1146tetrahydro2H2Hspiro(pyrimidine53quinolinium)4olate
1BUTYL16DIMETHYL46DIOXOSPIRO(24DIHYDRO1HQUINOLIN1IUM35PYRIMIDINE)2OLATE
1butyl16dimethylspiro(13diazinane5324dihydroquinoline)246trione
849005476
CCCCN1C(=O)C2(CC3=C(C=CC(=C3)C)N(C2)C)C(=O)NC1=O
CCCCN1C(=O)N=C(C2(C1=O)C(NH+)(C)c1c(C2)cc(cc1)C)(O)
InChI=1SC18H23N3O3c14582116(23)18(15(22)1917(21)24)1013912(2)6714(13)20(3)1118h679H4581011H213H3(H192224)
MFCD18245313
ZINC000002605359
ZINC000002605360
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