Vitas-M small molecule compound
5-({4-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxyphenoxy}methyl)furan-2-carboxylic acid
Catalog ID
STK201548
SMILES COc1cc(ccc1OCc1ccc(o1)C(=O)O)C=C1C(=O)NC(=S)NC1=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 C18H14N2O7S MW 402.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O7S/c1-25-14-7-9(6-11-15(21)19-18(28)20-16(11)22)2-4-12(14)26-8-10-3-5-13(27-10)17(23)24/h2-7H,8H2,1H3,(H,23,24)(H2,19,20,21,22,28)InChIKey
FTSPJMAYPYMMCH-UHFFFAOYSA-NSynonyms
5((4((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)FURAN2CARBOXYLICACID
5((4((46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)FURAN2CARBOXYLICACID
COC1=C(C=CC(=C1)C=C2C(=O)NC(=S)NC2=O)OCC3=CC=C(O3)C(=O)O
InChI=1SC18H14N2O7Sc1251479(61115(21)1918(28)2016(11)22)2412(14)268103513(2710)17(23)24h27H8H21H3(H2324)(H21920212228)
MFCD06666635
ZINC000004739814
ZINC4739814
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