Vitas-M small molecule compound
(5E)-1-(3,4-dimethylphenyl)-5-[2-methoxy-4-(morpholin-4-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL370141
SMILES COc1cc(ccc1/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(c(c1)C)C)N1CCOCC1
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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 C24H25N3O4S MW 451.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4S/c1-15-4-6-19(12-16(15)2)27-23(29)20(22(28)25-24(27)32)13-17-5-7-18(14-21(17)30-3)26-8-10-31-11-9-26/h4-7,12-14H,8-11H2,1-3H3,(H,25,28,32)/b20-13+InChIKey
VEHCUHJNDQTZCK-DEDYPNTBSA-NSynonyms
(5E)1(34DIMETHYLPHENYL)5((2METHOXY4MORPHOLIN4YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(34dimethylphenyl)5(2methoxy4(morpholin4yl)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=C(C=C(C=C3)N4CCOCC4)OC)C(=O)NC2=S)C
COc1cc(ccc1C=C1C(=O)NC(=S)N(C1=O)c1ccc(c(c1)C)C)N1CCOCC1
InChI=1SC24H25N3O4Sc1154619(1216(15)2)2723(29)20(22(28)2524(27)32)13175718(1421(17)303)268103111926h471214H811H213H3(H252832)b2013+
MFCD03214282
ZINC000001153021
ZINC01153021
ZINC1153021
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