Vitas-M small molecule compound
(5E)-5-[4-(benzyloxy)-3-ethoxybenzylidene]-1-(3-ethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK191777
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)OCC
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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 C28H26N2O5S MW 502.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O5S/c1-3-33-22-12-8-11-21(17-22)30-27(32)23(26(31)29-28(30)36)15-20-13-14-24(25(16-20)34-4-2)35-18-19-9-6-5-7-10-19/h5-17H,3-4,18H2,1-2H3,(H,29,31,36)/b23-15+InChIKey
OHUNQUJBXMQBHY-HZHRSRAPSA-NSynonyms
(5E)1(3ETHOXYPHENYL)5((3ETHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4(BENZYLOXY)3ETHOXYBENZYLIDENE)1(3ETHOXYPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1(3ETHOXYPHENYL)5((3ETHOXY4(PHENYLMETHOXY)PHENYL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
CCOC1=CC=CC(=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC)C(=O)NC2=S
CCOc1cc(ccc1OCc1ccccc1)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1)OCC
InChI=1SC28H26N2O5Sc1333221281121(1722)3027(32)23(26(31)2928(30)36)1520131424(25(1620)3442)35181996571019h517H3418H212H3(H293136)b2315+
MFCD02044577
ZINC000008955307
ZINC08955307
ZINC8955307
Check stock
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Check stock on Vitas-MAvailable files
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