Vitas-M small molecule compound
(5Z)-1-(4-bromo-2-methylphenyl)-5-(furan-2-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197549
SMILES Brc1ccc(c(c1)C)N1C(=S)NC(=O)/C(=C/c2ccco2)/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 C16H11BrN2O3S MW 391.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN2O3S/c1-9-7-10(17)4-5-13(9)19-15(21)12(14(20)18-16(19)23)8-11-3-2-6-22-11/h2-8H,1H3,(H,18,20,23)/b12-8-InChIKey
VJUIVHXIZRGSBA-WQLSENKSSA-NSynonyms
(5Z)1(4BROMO2METHYLPHENYL)5(FURAN2YLMETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4BROMO2METHYLPHENYL)5(FURAN2YLMETHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
Brc1ccc(c(c1)C)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O
CC1=C(C=CC(=C1)Br)N2C(=O)C(=CC3=CC=CO3)C(=O)NC2=S
InChI=1SC16H11BrN2O3Sc19710(17)4513(9)1915(21)12(14(20)1816(19)23)8113262211h28H1H3(H182023)b128
MFCD02628779
ZINC000004739016
ZINC04739016
ZINC4739016
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