Vitas-M small molecule compound
1'-methyl-8-nitro-2'-thioxo-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Catalog ID
STK683768
SMILES S=C1NC(=O)C2(C(=O)N1C)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 C16H16N4O5S MW 376.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O5S/c1-18-14(22)16(13(21)17-15(18)26)7-9-6-10(20(23)24)2-3-11(9)19-4-5-25-8-12(16)19/h2-3,6,12H,4-5,7-8H2,1H3,(H,17,21,26)InChIKey
LUILEKXJTXCSRN-UHFFFAOYSA-NSynonyms
1methyl8nitro2sulfanylidenespiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)46dione1methyl8nitro2thioxo1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)46(1H3H)dione
CN1C(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N4C2COCC4)C(=O)NC1=S
S=C1NC(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2COCC1)(N+)(=O)(O)
Registry IDs
MFCD05258712ZINC000004623727
ZINC000230027653
Check stock
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Check stock on Vitas-MAvailable files
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