Vitas-M small molecule compound
(5Z)-5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK178530
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)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 C23H17Cl2N3O3 MW 454.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2N3O3/c1-13-10-15(14(2)27(13)17-8-9-19(24)20(25)12-17)11-18-21(29)26-23(31)28(22(18)30)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,26,29,31)/b18-11-InChIKey
BXTARBPCEPCELX-WQRHYEAKSA-NSynonyms
(5Z)5((1(34DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1PHENYLPYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((1(34dichlorophenyl)25dimethylpyrrol3yl)methylidene)1phenyl13diazinane246trione
CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)Cl)C)C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4
InChI=1SC23H17Cl2N3O3c1131015(14(2)27(13)178919(24)20(25)1217)111821(29)2623(31)28(22(18)30)166435716h312H12H3(H262931)b1811
MFCD04277627
O=C1NC(=O)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)c1ccccc1
ZINC000009264660
ZINC09264660
ZINC9264660
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