Vitas-M small molecule compound
(5E)-1-(2-ethylphenyl)-5-[2-methyl-4-(morpholin-4-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK195529
SMILES CCc1ccccc1N1C(=S)NC(=O)/C(=C\c2ccc(cc2C)N2CCOCC2)/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 C24H25N3O3S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3S/c1-3-17-6-4-5-7-21(17)27-23(29)20(22(28)25-24(27)31)15-18-8-9-19(14-16(18)2)26-10-12-30-13-11-26/h4-9,14-15H,3,10-13H2,1-2H3,(H,25,28,31)/b20-15+InChIKey
QQPFWESRWZIKFI-HMMYKYKNSA-NSynonyms
(5E)1(2ETHYLPHENYL)5((2METHYL4MORPHOLIN4YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(2ETHYLPHENYL)5(2METHYL4(MORPHOLIN4YL)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCC1=CC=CC=C1N2C(=O)C(=CC3=C(C=C(C=C3)N4CCOCC4)C)C(=O)NC2=S
CCc1ccccc1N1C(=S)NC(=O)C(=Cc2ccc(cc2C)N2CCOCC2)C1=O
InChI=1SC24H25N3O3Sc1317645721(17)2723(29)20(22(28)2524(27)31)15188919(1416(18)2)26101230131126h491415H31013H212H3(H252831)b2015+
MFCD03994548
ZINC000001134415
ZINC01134415
ZINC1134415
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