Vitas-M small molecule compound
(5Z)-1-(3-methylphenyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK003135
SMILES Cc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)[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 C22H15N3O6 MW 417.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N3O6/c1-13-4-2-6-15(10-13)24-21(27)18(20(26)23-22(24)28)12-17-8-9-19(31-17)14-5-3-7-16(11-14)25(29)30/h2-12H,1H3,(H,23,26,28)/b18-12-InChIKey
HKKOKYQLSGKXDO-PDGQHHTCSA-NSynonyms
(5Z)1(3METHYLPHENYL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(3METHYLPHENYL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)NC2=O
Cc1cccc(c1)N1C(=O)NC(=O)C(=Cc2ccc(o2)c2cccc(c2)(N+)(=O)(O))C1=O
InChI=1SC22H15N3O6c11342615(1013)2421(27)18(20(26)2322(24)28)12178919(3117)1453716(1114)25(29)30h212H1H3(H232628)b1812
MFCD03183829
STK003135
ZINC000008916237
ZINC08916237
ZINC8916237
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