Vitas-M small molecule compound
(5Z)-5-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}-1-(3-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170472
SMILES CCOc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2cccn2c2ccc(cc2)Br)/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 C23H18BrN3O4 MW 480.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O4/c1-2-31-19-7-3-5-18(13-19)27-22(29)20(21(28)25-23(27)30)14-17-6-4-12-26(17)16-10-8-15(24)9-11-16/h3-14H,2H2,1H3,(H,25,28,30)/b20-14-InChIKey
KDLAYABYVUQDOW-ZHZULCJRSA-NSynonyms
(5Z)5((1(4BROMOPHENYL)1HPYRROL2YL)METHYLIDENE)1(3ETHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((1(4BROMOPHENYL)PYRROL2YL)METHYLIDENE)1(3ETHOXYPHENYL)13DIAZINANE246TRIONE
CCOC1=CC=CC(=C1)N2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)Br)C(=O)NC2=O
CCOc1cccc(c1)N1C(=O)NC(=O)C(=Cc2cccn2c2ccc(cc2)Br)C1=O
InChI=1SC23H18BrN3O4c12311973518(1319)2722(29)20(21(28)2523(27)30)1417641226(17)1610815(24)91116h314H2H21H3(H252830)b2014
MFCD02624421
ZINC000006389403
ZINC06389403
ZINC6389403
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