Vitas-M small molecule compound
(5E)-1-(2,3-dichlorophenyl)-5-[2-methoxy-4-(morpholin-4-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL370136
SMILES COc1cc(ccc1/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl)N1CCOCC1
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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 C22H19Cl2N3O4S MW 492.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2N3O4S/c1-30-18-12-14(26-7-9-31-10-8-26)6-5-13(18)11-15-20(28)25-22(32)27(21(15)29)17-4-2-3-16(23)19(17)24/h2-6,11-12H,7-10H2,1H3,(H,25,28,32)/b15-11+InChIKey
DKIGHGVUMOKQEI-RVDMUPIBSA-NSynonyms
(5E)1(23DICHLOROPHENYL)5((2METHOXY4MORPHOLIN4YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(23dichlorophenyl)5(2methoxy4(morpholin4yl)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
COC1=C(C=CC(=C1)N2CCOCC2)C=C3C(=O)NC(=S)N(C3=O)C4=C(C(=CC=C4)Cl)Cl
COc1cc(ccc1C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl)N1CCOCC1
InChI=1SC22H19Cl2N3O4Sc130181214(26793110826)6513(18)111520(28)2522(32)27(21(15)29)1742316(23)19(17)24h261112H710H21H3(H252832)b1511+
MFCD03214258
ZINC000016183447
ZINC16183447
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