Vitas-M small molecule compound

(5E)-5-[4-(diethylamino)-2-methoxybenzylidene]-1-(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK727465
SMILES COc1cc(ccc1/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1C)N(CC)CC

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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 C23H25N3O3S MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O3S/c1-5-25(6-2)17-12-11-16(20(14-17)29-4)13-18-21(27)24-23(30)26(22(18)28)19-10-8-7-9-15(19)3/h7-14H,5-6H2,1-4H3,(H,24,27,30)/b18-13+
InChIKey
JHUMIMKREBETEA-QGOAFFKASA-N
Synonyms

(5E)5((4(DIETHYLAMINO)2METHOXYPHENYL)METHYLIDENE)1(2METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4(diethylamino)2methoxybenzylidene)1(2methylphenyl)2thioxodihydropyrimidine46(1H5H)dione
5(4(DIETHYLAMINO)2METHOXYBENZYLIDENE)1(2METHYLPHENYL)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3C)OC
COc1cc(ccc1C=C1C(=O)NC(=S)N(C1=O)c1ccccc1C)N(CC)CC
InChI=1SC23H25N3O3Sc1525(62)17121116(20(1417)294)131821(27)2423(30)26(22(18)28)191087915(19)3h714H56H214H3(H242730)b1813+
MFCD01460175
ZINC000000706674
ZINC00706674
ZINC706674

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Available files

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