Vitas-M small molecule compound
2-(4-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-ethoxyphenoxy)acetamide
Catalog ID
STK187222
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccc(c(c2)OCC)OCC(=O)N)/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 C18H19N3O5S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O5S/c1-3-7-21-17(24)12(16(23)20-18(21)27)8-11-5-6-13(26-10-15(19)22)14(9-11)25-4-2/h3,5-6,8-9H,1,4,7,10H2,2H3,(H2,19,22)(H,20,23,27)/b12-8+InChIKey
FJHGZAQOJNUOGH-XYOKQWHBSA-NSynonyms
2(4((E)(46DIOXO1(PROP2EN1YL)2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2ETHOXYPHENOXY)ACETAMIDE
2(4((E)(46DIOXO1PROP2ENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2ETHOXYPHENOXY)ACETAMIDE
C=CCN1C(=S)NC(=O)C(=Cc2ccc(c(c2)OCC)OCC(=O)N)C1=O
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)OCC(=O)N
InChI=1SC18H19N3O5Sc1372117(24)12(16(23)2018(21)27)8115613(261015(19)22)14(911)2542h35689H14710H22H3(H21922)(H202327)b128+
MFCD03706361
ZINC000001139705
ZINC01139705
ZINC1139705
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