Vitas-M small molecule compound
(5E)-5-{[(2-chloro-4-nitrophenyl)amino]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL359293
SMILES Cc1cccc(c1)N1C(=O)NC(=O)/C(=C\Nc2ccc(cc2Cl)[N+](=O)[O-])/C1=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 C18H13ClN4O5 MW 400.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN4O5/c1-10-3-2-4-11(7-10)22-17(25)13(16(24)21-18(22)26)9-20-15-6-5-12(23(27)28)8-14(15)19/h2-9,20H,1H3,(H,21,24,26)/b13-9+InChIKey
BQGIIWMOZOIYKO-UKTHLTGXSA-NSynonyms
(5E)5(((2chloro4nitrophenyl)amino)methylidene)1(3methylphenyl)pyrimidine246(1H3H5H)trione
(5E)5((2chloro4nitroanilino)methylidene)1(3methylphenyl)13diazinane246trione
CC1=CC(=CC=C1)N2C(=O)C(=CNC3=C(C=C(C=C3)(N+)(=O)(O))Cl)C(=O)NC2=O
Cc1cccc(c1)N1C(=O)NC(=O)C(=CNc2ccc(cc2Cl)(N+)(=O)(O))C1=O
InChI=1SC18H13ClN4O5c11032411(710)2217(25)13(16(24)2118(22)26)920156512(23(27)28)814(15)19h2920H1H3(H212426)b139+
MFCD28033633
ZINC000095471459
ZINC95471459
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