Vitas-M small molecule compound
(5Z)-5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK063248
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])c1ccccc1
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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 C21H12ClN3O6 MW 437.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12ClN3O6/c22-17-10-13(25(29)30)6-8-15(17)18-9-7-14(31-18)11-16-19(26)23-21(28)24(20(16)27)12-4-2-1-3-5-12/h1-11H,(H,23,26,28)/b16-11-InChIKey
AVXSNWOQUAJGIE-WJDWOHSUSA-NSynonyms
(5Z)5((5(2CHLORO4NITROPHENYL)FURAN2YL)METHYLIDENE)1PHENYL13DIAZINANE246TRIONE
(5Z)5((5(2CHLORO4NITROPHENYL)FURAN2YL)METHYLIDENE)1PHENYLPYRIMIDINE246(1H3H5H)TRIONE
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)(N+)(=O)(O))Cl)C(=O)NC2=O
InChI=1SC21H12ClN3O6c22171013(25(29)30)6815(17)189714(3118)111619(26)2321(28)24(20(16)27)124213512h111H(H232628)b1611
MFCD02212756
O=C1NC(=O)N(C(=O)C1=Cc1ccc(o1)c1ccc(cc1Cl)(N+)(=O)(O))c1ccccc1
STK063248
ZINC000013897222
ZINC13897222
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