Vitas-M small molecule compound
2-(4-{(Z)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)propanoic acid
Catalog ID
STK188265
SMILES C=CCN1C(=S)NC(=O)/C(=C/c2ccc(c(c2)OC)OC(C(=O)O)C)/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 C18H18N2O6S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O6S/c1-4-7-20-16(22)12(15(21)19-18(20)27)8-11-5-6-13(14(9-11)25-3)26-10(2)17(23)24/h4-6,8-10H,1,7H2,2-3H3,(H,23,24)(H,19,21,27)/b12-8-InChIKey
LEEDAAQGAMPLNL-WQLSENKSSA-NSynonyms
2(4((Z)(46DIOXO1(PROP2EN1YL)2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENOXY)PROPANOICACID
2(4((Z)(46DIOXO1PROP2ENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)PROPANOICACID
C=CCN1C(=S)NC(=O)C(=Cc2ccc(c(c2)OC)OC(C(=O)O)C)C1=O
CC(C(=O)O)OC1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)OC
InChI=1SC18H18N2O6Sc1472016(22)12(15(21)1918(20)27)8115613(14(911)253)2610(2)17(23)24h46810H17H223H3(H2324)(H192127)b128
MFCD03561954
ZINC000016225628
ZINC000016225630
Check stock
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