Vitas-M small molecule compound
5-({[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK878418
SMILES O=C1NC(=S)NC(=O)C1=CNc1scc(n1)c1cc2cc(Br)ccc2oc1=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 C17H9BrN4O4S2 MW 477.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9BrN4O4S2/c18-8-1-2-12-7(3-8)4-9(15(25)26-12)11-6-28-17(20-11)19-5-10-13(23)21-16(27)22-14(10)24/h1-6H,(H,19,20)(H2,21,22,23,24,27)InChIKey
GDRJNNIHPSWMOG-UHFFFAOYSA-NSynonyms
5(((4(6bromo2oxo2Hchromen3yl)13thiazol2yl)amino)methylidene)2thioxodihydropyrimidine46(1H5H)dione
5(((4(6bromo2oxochromen3yl)13thiazol2yl)amino)methylidene)2sulfanylidene13diazinane46dione
C1=CC2=C(C=C1Br)C=C(C(=O)O2)C3=CSC(=N3)NC=C4C(=O)NC(=S)NC4=O
InChI=1SC17H9BrN4O4S2c18812127(38)49(15(25)2612)1162817(2011)1951013(23)2116(27)2214(10)24h16H(H1920)(H22122232427)
MFCD18170290
ZINC000040476906
ZINC40476906
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