Vitas-M small molecule compound
(5Z)-1-(4-methoxyphenyl)-5-{[5-(2-methyl-4-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK098860
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2C)[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 C23H17N3O7 MW 447.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O7/c1-13-11-15(26(30)31)5-9-18(13)20-10-8-17(33-20)12-19-21(27)24-23(29)25(22(19)28)14-3-6-16(32-2)7-4-14/h3-12H,1-2H3,(H,24,27,29)/b19-12-InChIKey
LVTHTCJJKUQDAE-UNOMPAQXSA-NSynonyms
(5Z)1(4METHOXYPHENYL)5((5(2METHYL4NITROPHENYL)FURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(4METHOXYPHENYL)5((5(2METHYL4NITROPHENYL)FURAN2YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(o2)c2ccc(cc2C)(N+)(=O)(O))C1=O
InChI=1SC23H17N3O7c1131115(26(30)31)5918(13)2010817(3320)121921(27)2423(29)25(22(19)28)143616(322)7414h312H12H3(H242729)b1912
MFCD02212530
STK098860
ZINC000001200955
ZINC1200955
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