Vitas-M small molecule compound

3'-(2,4-dimethylphenyl)-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
STK579832
SMILES CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1C)C)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 C25H26N4O6 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O6/c1-13-5-7-19(14(2)9-13)28-23(31)25(22(30)26-24(28)32)11-17-10-18(29(33)34)6-8-20(17)27-12-15(3)35-16(4)21(25)27/h5-10,15-16,21H,11-12H2,1-4H3,(H,26,30,32)
InChIKey
LCICRFYDKGVTOL-UHFFFAOYSA-N
Synonyms
1024355-09-6
1(24dimethylphenyl)24dimethyl8nitrospiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
1024355096
3(24dimethylphenyl)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=C(C=C(C=C5)C)C
CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1C)C)O)(N+)(=O)(O)
InChI=1SC25H26N4O6c1135719(14(2)913)2823(31)25(22(30)2624(28)32)11171018(29(33)34)6820(17)271215(3)3516(4)21(25)27h510151621H1112H214H3(H263032)
MFCD07202757
ZINC000102782708
ZINC000245326516

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Available files

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