Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(pyridin-4-yl)-1H-pyrrol-3-yl]methylidene}-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176345
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cc(n(c2C)c2ccncc2)C)/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 C24H22N4O3 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3/c1-4-17-5-7-19(8-6-17)28-23(30)21(22(29)26-24(28)31)14-18-13-15(2)27(16(18)3)20-9-11-25-12-10-20/h5-14H,4H2,1-3H3,(H,26,29,31)/b21-14+InChIKey
GASXQRAZNXZTKO-KGENOOAVSA-NSynonyms
(5E)5((25DIMETHYL1(PYRIDIN4YL)1HPYRROL3YL)METHYLIDENE)1(4ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5E)5((25DIMETHYL1PYRIDIN4YLPYRROL3YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=NC=C4)C)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cc(n(c2C)c2ccncc2)C)C1=O
InChI=1SC24H22N4O3c14175719(8617)2823(30)21(22(29)2624(28)31)14181315(2)27(16(18)3)2091125121020h514H4H213H3(H262931)b2114+
MFCD03704915
ZINC000001162737
ZINC01162737
ZINC1162737
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