Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[4-(morpholin-4-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL375476
SMILES Brc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2ccc(cc2)N2CCOCC2)/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 C21H18BrN3O3S MW 472.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN3O3S/c22-15-3-7-17(8-4-15)25-20(27)18(19(26)23-21(25)29)13-14-1-5-16(6-2-14)24-9-11-28-12-10-24/h1-8,13H,9-12H2,(H,23,26,29)/b18-13+InChIKey
DFXFEPGFDTZVKJ-QGOAFFKASA-NSynonyms
(5E)1(4BROMOPHENYL)5((4MORPHOLIN4YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(4bromophenyl)5(4(morpholin4yl)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
Brc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccc(cc2)N2CCOCC2)C1=O
C1COCCN1C2=CC=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)Br
InChI=1SC21H18BrN3O3Sc22153717(8415)2520(27)18(19(26)2321(25)29)13141516(6214)2491128121024h1813H912H2(H232629)b1813+
MFCD03214367
ZINC000001154585
ZINC01154585
ZINC1154585
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