Vitas-M small molecule compound
(5Z)-6-hydroxy-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK612429
SMILES Cc1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(o2)c2ccc(c(c2)[N+](=O)[O-])C)/C1=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 C23H17N3O6 MW 431.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O6/c1-13-3-7-16(8-4-13)25-22(28)18(21(27)24-23(25)29)12-17-9-10-20(32-17)15-6-5-14(2)19(11-15)26(30)31/h3-12H,1-2H3,(H,24,27,29)/b18-12-InChIKey
SFFZGOOTOGPFSM-PDGQHHTCSA-NSynonyms
(5Z)5((5(4METHYL3NITROPHENYL)FURAN2YL)METHYLIDENE)1(4METHYLPHENYL)13DIAZINANE246TRIONE
(5Z)6hydroxy5((5(4methyl3nitrophenyl)furan2yl)methylidene)3(4methylphenyl)pyrimidine24(3H5H)dione
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)C)(N+)(=O)(O))C(=O)NC2=O
Cc1ccc(cc1)N1C(=O)N=C(C(=Cc2ccc(o2)c2ccc(c(c2)(N+)(=O)(O))C)C1=O)O
InChI=1SC23H17N3O6c1133716(8413)2522(28)18(21(27)2423(25)29)121791020(3217)156514(2)19(1115)26(30)31h312H12H3(H242729)b1812
MFCD08732128
ZINC000009435976
ZINC09435976
ZINC9435976
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