Vitas-M small molecule compound
(5E)-1-(2,3-dichlorophenyl)-5-[4-(prop-2-yn-1-yloxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL374347
SMILES C#CCOc1ccc(cc1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
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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 C20H12Cl2N2O3S MW 431.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12Cl2N2O3S/c1-2-10-27-13-8-6-12(7-9-13)11-14-18(25)23-20(28)24(19(14)26)16-5-3-4-15(21)17(16)22/h1,3-9,11H,10H2,(H,23,25,28)/b14-11+InChIKey
HASFEJOLNZLCAP-SDNWHVSQSA-NSynonyms
(5E)1(23DICHLOROPHENYL)5((4PROP2YNOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(23dichlorophenyl)5(4(prop2yn1yloxy)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
1(23DICHLOROPHENYL)5((4PROP2YNYLOXYPHENYL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
C#CCOC1=CC=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C(=CC=C3)Cl)Cl
C#CCOc1ccc(cc1)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
InChI=1SC20H12Cl2N2O3Sc121027138612(7913)111418(25)2320(28)24(19(14)26)1653415(21)17(16)22h13911H10H2(H232528)b1411+
MFCD02637484
ZINC000002972178
ZINC02972178
ZINC2972178
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