Vitas-M small molecule compound
(5E)-1-(2,4-dichlorophenyl)-5-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175111
SMILES CCc1ccccc1n1c(C)cc(c1C)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1Cl)Cl
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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 C25H21Cl2N3O3 MW 482.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21Cl2N3O3/c1-4-16-7-5-6-8-21(16)29-14(2)11-17(15(29)3)12-19-23(31)28-25(33)30(24(19)32)22-10-9-18(26)13-20(22)27/h5-13H,4H2,1-3H3,(H,28,31,33)/b19-12+InChIKey
WDFUAMNGUJSUBL-XDHOZWIPSA-NSynonyms
(5E)1(24DICHLOROPHENYL)5((1(2ETHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5E)1(24DICHLOROPHENYL)5((1(2ETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
CCC1=CC=CC=C1N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=C(C=C(C=C4)Cl)Cl)C
CCc1ccccc1n1c(C)cc(c1C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1Cl)Cl
InChI=1SC25H21Cl2N3O3c1416756821(16)2914(2)1117(15(29)3)121923(31)2825(33)30(24(19)32)2210918(26)1320(22)27h513H4H213H3(H283133)b1912+
MFCD03706319
ZINC000001150270
ZINC01150270
ZINC1150270
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