Vitas-M small molecule compound
6-hydroxy-1'-methyl-6'-nitro-2-sulfanyl-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
Catalog ID
STK854263
SMILES SC1=NC(=O)C2(C(=N1)O)CN(C)c1c(C2)cc(cc1)[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 C13H12N4O4S MW 320.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O4S/c1-16-6-13(10(18)14-12(22)15-11(13)19)5-7-4-8(17(20)21)2-3-9(7)16/h2-4H,5-6H2,1H3,(H2,14,15,18,19,22)InChIKey
SWWYOTWIUHOSOC-UHFFFAOYSA-NSynonyms
696606-47-01methyl6nitro2sulfanylidenespiro(13diazinane5324dihydroquinoline)46dione
696606470
6hydroxy1methyl6nitro2sulfanyl14dihydro2H4Hspiro(pyrimidine53quinolin)4one
CN1CC2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)NC(=S)NC2=O
InChI=1SC13H12N4O4Sc116613(10(18)1412(22)1511(13)19)5748(17(20)21)239(7)16h24H56H21H3(H21415181922)
MFCD08733828
SC1=NC(=O)C2(C(=N1)O)CN(C)c1c(C2)cc(cc1)(N+)(=O)(O)
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