Vitas-M small molecule compound
(5Z)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-1-(4-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK846311
SMILES COc1ccc(cc1)N1C(=NC(=O)/C(=C/C=C/c2ccco2)/C1=O)S
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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 C18H14N2O4S MW 354.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O4S/c1-23-13-9-7-12(8-10-13)20-17(22)15(16(21)19-18(20)25)6-2-4-14-5-3-11-24-14/h2-11H,1H3,(H,19,21,25)/b4-2+,15-6-InChIKey
KEBBVAUQERDWIL-RPGBBNPCSA-NSynonyms
(5Z)5((2E)3(furan2yl)prop2en1ylidene)1(4methoxyphenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((E)3(FURAN2YL)PROP2ENYLIDENE)1(4METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
COC1=CC=C(C=C1)N2C(=O)C(=CC=CC3=CC=CO3)C(=O)NC2=S
COc1ccc(cc1)N1C(=NC(=O)C(=CC=Cc2ccco2)C1=O)S
InChI=1SC18H14N2O4Sc123139712(81013)2017(22)15(16(21)1918(20)25)6241453112414h211H1H3(H192125)b42+156
MFCD03808426
ZINC000017146413
ZINC17146413
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