Vitas-M small molecule compound
(5E)-1-(3-chloro-4-methoxyphenyl)-5-{[1-(2-methylbenzyl)-1H-pyrrol-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK070045
SMILES COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C\c2cccn2Cc2ccccc2C)/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 C24H20ClN3O4 MW 449.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O4/c1-15-6-3-4-7-16(15)14-27-11-5-8-17(27)12-19-22(29)26-24(31)28(23(19)30)18-9-10-21(32-2)20(25)13-18/h3-13H,14H2,1-2H3,(H,26,29,31)/b19-12+InChIKey
XBVPIUXXYGTZTF-XDHOZWIPSA-NSynonyms
(5E)1(3CHLORO4METHOXYPHENYL)5((1((2METHYLPHENYL)METHYL)PYRROL2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(3CHLORO4METHOXYPHENYL)5((1(2METHYLBENZYL)1HPYRROL2YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(Z)1(3chloro4methoxyphenyl)5((1(2methylbenzyl)1Hpyrrol2yl)methylene)pyrimidine246(1H3H5H)trione
CC1=CC=CC=C1CN2C=CC=C2C=C3C(=O)NC(=O)N(C3=O)C4=CC(=C(C=C4)OC)Cl
COc1ccc(cc1Cl)N1C(=O)NC(=O)C(=Cc2cccn2Cc2ccccc2C)C1=O
InChI=1SC24H20ClN3O4c115634716(15)1427115817(27)121922(29)2624(31)28(23(19)30)1891021(322)20(25)1318h313H14H212H3(H262931)b1912+
MFCD08051928
STK070045
ZINC000008768244
ZINC8768244
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