Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197630
SMILES COc1cc(ccc1O)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)Br
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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 C18H13BrN2O4S MW 433.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN2O4S/c1-25-15-9-10(2-7-14(15)22)8-13-16(23)20-18(26)21(17(13)24)12-5-3-11(19)4-6-12/h2-9,22H,1H3,(H,20,23,26)/b13-8+InChIKey
KSQHHPRHPDCIMM-MDWZMJQESA-NSynonyms
(5E)1(4BROMOPHENYL)5((4HYDROXY3METHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(4BROMOPHENYL)5(4HYDROXY3METHOXYBENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1(4BROMOPHENYL)5(4HYDROXY3METHOXYBENZYLIDENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
COC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Br)O
COc1cc(ccc1O)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)Br
InChI=1SC18H13BrN2O4Sc12515910(2714(15)22)81316(23)2018(26)21(17(13)24)125311(19)4612h2922H1H3(H202326)b138+
MFCD01836079
ZINC000002121615
ZINC02121615
ZINC2121615
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