Vitas-M small molecule compound
5-[2-(2,4-dimethylpiperidin-1-yl)-5-nitrobenzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK757609
SMILES CC1CCN(C(C1)C)c1ccc(cc1C=C1C(=O)NC(=S)NC1=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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-10-5-6-21(11(2)7-10)15-4-3-13(22(25)26)8-12(15)9-14-16(23)19-18(27)20-17(14)24/h3-4,8-11H,5-7H2,1-2H3,(H2,19,20,23,24,27)InChIKey
DCZRQFCWXNFUKS-UHFFFAOYSA-NSynonyms
5((2(24DIMETHYLPIPERIDIN1YL)5NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(2(24DIMETHYL1PIPERIDINYL)5NITROBENZYLIDENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
5(2(24dimethylpiperidin1yl)5nitrobenzylidene)2thioxodihydropyrimidine46(1H5H)dione
CC1CCN(C(C1)C)c1ccc(cc1C=C1C(=O)NC(=S)NC1=O)(N+)(=O)(O)
CC1CCN(C(C1)C)C2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)NC(=S)NC3=O
InChI=1SC18H20N4O4Sc1105621(11(2)710)154313(22(25)26)812(15)91416(23)1918(27)2017(14)24h34811H57H212H3(H21920232427)
MFCD00754821
ZINC000004181711
ZINC000015188040
Check stock
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Check stock on Vitas-MAvailable files
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