Vitas-M small molecule compound

3'-(3-chlorophenyl)-6'-hydroxy-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione

Catalog ID
STK587870
SMILES CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1cccc(c1)Cl)O)[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 C23H21ClN4O6 MW 484.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O6/c1-12-11-26-18-7-6-17(28(32)33)8-14(18)10-23(19(26)13(2)34-12)20(29)25-22(31)27(21(23)30)16-5-3-4-15(24)9-16/h3-9,12-13,19H,10-11H2,1-2H3,(H,25,29,31)
InChIKey
YUIRQXJSEOGENO-UHFFFAOYSA-N
Synonyms
1024305-92-7
1(3chlorophenyl)24dimethyl8nitrospiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
1024305927
3(3chlorophenyl)6hydroxy24dimethyl8nitro1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)24(3H)dione
CC1CN2C(C(O1)C)C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)C5=CC(=CC=C5)Cl
CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1cccc(c1)Cl)O)(N+)(=O)(O)
InChI=1SC23H21ClN4O6c1121126187617(28(32)33)814(18)1023(19(26)13(2)3412)20(29)2522(31)27(21(23)30)1653415(24)916h39121319H1011H212H3(H252931)
MFCD07201443
ZINC000009448624
ZINC000248056592

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Available files

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