Vitas-M small molecule compound
1'-(butan-2-yl)-3-nitro-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Catalog ID
STK724659
SMILES CCC(N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-])C
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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 C21H26N4O5 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O5/c1-3-13(2)24-19(27)21(18(26)22-20(24)28)12-14-11-15(25(29)30)8-9-16(14)23-10-6-4-5-7-17(21)23/h8-9,11,13,17H,3-7,10,12H2,1-2H3,(H,22,26,28)InChIKey
MBRANFPVIJLCSR-UHFFFAOYSA-NSynonyms
1008644-99-21(butan2yl)3nitro6a7891011hexahydro2H5Hspiro(azepino(12a)quinoline65pyrimidine)246(1H3H)trione
1(secbutyl)3nitro6a7891011hexahydro1H5Hspiro(azepino(12a)quinoline65pyrimidine)246(3H)trione
1008644992
1butan2yl3nitrospiro(13diazinane566a7891011hexahydro5Hazepino(12a)quinoline)246trione
CCC(C)N1C(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N4C2CCCCC4)C(=O)NC1=O
CCC(N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)(N+)(=O)(O))C
InChI=1SC21H26N4O5c1313(2)2419(27)21(18(26)2220(24)28)12141115(25(29)30)8916(14)2310645717(21)23h89111317H371012H212H3(H222628)
MFCD07637960
ZINC000008995959
ZINC000229900634
Check stock
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