Vitas-M small molecule compound
(5Z)-5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK326812
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)Cc1ccco1
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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 C22H17Cl2N3O4 MW 458.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N3O4/c1-12-8-14(13(2)27(12)15-5-6-18(23)19(24)10-15)9-17-20(28)25-22(30)26(21(17)29)11-16-4-3-7-31-16/h3-10H,11H2,1-2H3,(H,25,28,30)/b17-9-InChIKey
BRGIQPUSGXBJHA-MFOYZWKCSA-NSynonyms
(5Z)5((1(34DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(FURAN2YLMETHYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((1(34dichlorophenyl)25dimethylpyrrol3yl)methylidene)1(furan2ylmethyl)13diazinane246trione
CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)Cl)C)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4
InChI=1SC22H17Cl2N3O4c112814(13(2)27(12)155618(23)19(24)1015)91720(28)2522(30)26(21(17)29)11164373116h310H11H212H3(H252830)b179
MFCD02196069
O=C1NC(=O)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)Cc1ccco1
ZINC000018190322
ZINC18190322
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