Vitas-M small molecule compound

1'-(4-fluorophenyl)-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

Catalog ID
STK724733
SMILES Fc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2COCC1)[N+](=O)[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 C21H17FN4O6 MW 440.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN4O6/c22-13-1-3-14(4-2-13)25-19(28)21(18(27)23-20(25)29)10-12-9-15(26(30)31)5-6-16(12)24-7-8-32-11-17(21)24/h1-6,9,17H,7-8,10-11H2,(H,23,27,29)
InChIKey
JFSQCMFCQWCEPE-UHFFFAOYSA-N
Synonyms
879577-73-8
1(4fluorophenyl)8nitro1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)246(1H3H)trione
1(4fluorophenyl)8nitro244a6tetrahydro1H1Hspiro((14)oxazino(43a)quinoline55pyrimidine)246(3H)trione
1(4fluorophenyl)8nitrospiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
879577738
C1COCC2N1C3=C(CC24C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)F)C=C(C=C3)(N+)(=O)(O)
Fc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2COCC1)(N+)(=O)(O)
InChI=1SC21H17FN4O6c22131314(4213)2519(28)21(18(27)2320(25)29)1012915(26(30)31)5616(12)2478321117(21)24h16917H781011H2(H232729)
MFCD07638375
ZINC000009123266
ZINC000230055215

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Available files

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