Vitas-M small molecule compound
8-nitro-1'-phenyl-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
STK661484
SMILES O=C1NC(=O)C2(C(=O)N1c1ccccc1)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 C21H18N4O6 MW 422.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O6/c26-18-21(19(27)24(20(28)22-18)14-4-2-1-3-5-14)11-13-10-15(25(29)30)6-7-16(13)23-8-9-31-12-17(21)23/h1-7,10,17H,8-9,11-12H2,(H,22,26,28)InChIKey
OGNGFNUEJLXBRZ-UHFFFAOYSA-NSynonyms
8nitro1phenyl1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)246(1H3H)trione
8nitro1phenylspiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
C1COCC2N1C3=C(CC24C(=O)NC(=O)N(C4=O)C5=CC=CC=C5)C=C(C=C3)(N+)(=O)(O)
InChI=1SC21H18N4O6c261821(19(27)24(20(28)2218)144213514)11131015(25(29)30)6716(13)2389311217(21)23h171017H891112H2(H222628)
MFCD05858157
O=C1NC(=O)C2(C(=O)N1c1ccccc1)Cc1cc(ccc1N1C2COCC1)(N+)(=O)(O)
ZINC000009123241
ZINC000247405250
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