Vitas-M small molecule compound
5-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK058028
SMILES O=C1NC(=O)C(=Cc2ccc(o2)Sc2ccc(cc2)C)C(=O)N1
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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 C16H12N2O4S MW 328.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O4S/c1-9-2-5-11(6-3-9)23-13-7-4-10(22-13)8-12-14(19)17-16(21)18-15(12)20/h2-8H,1H3,(H2,17,18,19,20,21)InChIKey
UPXCNMKGIXUQKJ-UHFFFAOYSA-NSynonyms
5((5((4METHYLPHENYL)SULFANYL)FURAN2YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
5((5(4METHYLPHENYL)SULFANYLFURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
5((5(4METHYLPHENYLTHIO)2FURYL)METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
CC1=CC=C(C=C1)SC2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O
InChI=1SC16H12N2O4Sc192511(639)23137410(2213)81214(19)1716(21)1815(12)20h28H1H3(H21718192021)
MFCD01873271
O=C1NC(=O)C(=Cc2ccc(o2)Sc2ccc(cc2)C)C(=O)N1
STK058028
ZINC000004502445
ZINC04502445
ZINC4502445
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