Vitas-M small molecule compound
ethyl 4-(4-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-5-oxo-3-[(pyridin-3-ylcarbonyl)amino]-2-thioxoimidazolidin-1-yl)benzoate
Catalog ID
STK662948
SMILES CCOC(=O)c1ccc(cc1)N1C(=S)N(C(C1=O)CC(=O)Nc1ccc(cc1)F)NC(=O)c1cccnc1
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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 C26H22FN5O5S MW 535.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22FN5O5S/c1-2-37-25(36)16-5-11-20(12-6-16)31-24(35)21(14-22(33)29-19-9-7-18(27)8-10-19)32(26(31)38)30-23(34)17-4-3-13-28-15-17/h3-13,15,21H,2,14H2,1H3,(H,29,33)(H,30,34)InChIKey
XZQXQJUSLXUQKD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)NC(=O)C3=CN=CC=C3)CC(=O)NC4=CC=C(C=C4)F
ethyl4(4(2((4fluorophenyl)amino)2oxoethyl)5oxo3((pyridin3ylcarbonyl)amino)2thioxoimidazolidin1yl)benzoate
ETHYL4(4(2(4FLUOROANILINO)2OXOETHYL)5OXO3(PYRIDINE3CARBONYLAMINO)2SULFANYLIDENEIMIDAZOLIDIN1YL)BENZOATE
InChI=1SC26H22FN5O5Sc123725(36)1651120(12616)3124(35)21(1422(33)29199718(27)81019)32(26(31)38)3023(34)174313281517h3131521H214H21H3(H2933)(H3034)
MFCD03766467
ZINC000098005120
ZINC000098005121
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