Vitas-M small molecule compound
ethyl 4-[4-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-5-oxo-3-(pyridin-3-ylmethyl)-2-thioxoimidazolidin-1-yl]benzoate
Catalog ID
STK111214
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C(N(C1=S)Cc1cccnc1)CC(=O)Nc1ccc(cc1)F
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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 C26H23FN4O4S MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN4O4S/c1-2-35-25(34)18-5-11-21(12-6-18)31-24(33)22(14-23(32)29-20-9-7-19(27)8-10-20)30(26(31)36)16-17-4-3-13-28-15-17/h3-13,15,22H,2,14,16H2,1H3,(H,29,32)InChIKey
IOLQYKOXGLDIRC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CC3=CN=CC=C3)CC(=O)NC4=CC=C(C=C4)F
ETHYL4(4(2((4FLUOROPHENYL)AMINO)2OXOETHYL)5OXO3(PYRIDIN3YLMETHYL)2THIOXOIMIDAZOLIDIN1YL)BENZOATE
ETHYL4(4(2(4FLUOROANILINO)2OXOETHYL)5OXO3(PYRIDIN3YLMETHYL)2SULFANYLIDENEIMIDAZOLIDIN1YL)BENZOATE
InChI=1SC26H23FN4O4Sc123525(34)1851121(12618)3124(33)22(1423(32)29209719(27)81020)30(26(31)36)16174313281517h3131522H21416H21H3(H2932)
MFCD03820421
ZINC000009763281
ZINC000009763282
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