Vitas-M small molecule compound
2-methyl-3-(5-{(E)-[1-(2-methylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK112206
SMILES O=C1NC(=S)N(C(=O)/C/1=C/c1ccc(o1)c1cccc(c1C)C(=O)O)c1ccccc1C
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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 C24H18N2O5S MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O5S/c1-13-6-3-4-9-19(13)26-22(28)18(21(27)25-24(26)32)12-15-10-11-20(31-15)16-7-5-8-17(14(16)2)23(29)30/h3-12H,1-2H3,(H,29,30)(H,25,27,32)/b18-12+InChIKey
ZGPMVNXNXXNCRQ-LDADJPATSA-NSynonyms
2METHYL3(5((E)(1(2METHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2METHYL3(5((E)(1(2METHYLPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
CC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(O3)C4=C(C(=CC=C4)C(=O)O)C)C(=O)NC2=S
InChI=1SC24H18N2O5Sc113634919(13)2622(28)18(21(27)2524(26)32)1215101120(3115)1675817(14(16)2)23(29)30h312H12H3(H2930)(H252732)b1812+
MFCD05625537
O=C1NC(=S)N(C(=O)C1=Cc1ccc(o1)c1cccc(c1C)C(=O)O)c1ccccc1C
ZINC000009323244
ZINC9323244
Check stock
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