Vitas-M small molecule compound
(5E)-5-{4-[(4-chlorobenzyl)oxy]-3-iodo-5-methoxybenzylidene}-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK079450
SMILES COc1cc(cc(c1OCc1ccc(cc1)Cl)I)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)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 C25H17Cl2IN2O5 MW 623.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17Cl2IN2O5/c1-34-21-12-15(11-20(28)22(21)35-13-14-2-4-16(26)5-3-14)10-19-23(31)29-25(33)30(24(19)32)18-8-6-17(27)7-9-18/h2-12H,13H2,1H3,(H,29,31,33)/b19-10+InChIKey
PCMQXAOCPSTUJW-VXLYETTFSA-NSynonyms
(5E)1(4CHLOROPHENYL)5((4((4CHLOROPHENYL)METHOXY)3IODO5METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)5(4((4CHLOROBENZYL)OXY)3IODO5METHOXYBENZYLIDENE)1(4CHLOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)I)OCC4=CC=C(C=C4)Cl
COc1cc(cc(c1OCc1ccc(cc1)Cl)I)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
InChI=1SC25H17Cl2IN2O5c134211215(1120(28)22(21)3513142416(26)5314)101923(31)2925(33)30(24(19)32)188617(27)7918h212H13H21H3(H293133)b1910+
MFCD08672749
STK079450
ZINC000097959058
ZINC97959058
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