Vitas-M small molecule compound
ethyl 4-({[1-(4-fluorophenyl)-3-(4-methoxybenzyl)-5-oxo-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate
Catalog ID
STK112086
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1Cc1ccc(cc1)OC)c1ccc(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 C28H26FN3O5S MW 535.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26FN3O5S/c1-3-37-27(35)19-6-10-21(11-7-19)30-25(33)16-24-26(34)32(22-12-8-20(29)9-13-22)28(38)31(24)17-18-4-14-23(36-2)15-5-18/h4-15,24H,3,16-17H2,1-2H3,(H,30,33)InChIKey
BYYJCLRALJJTBQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC=C(C=C3)OC)C4=CC=C(C=C4)F
ETHYL4(((1(4FLUOROPHENYL)3(4METHOXYBENZYL)5OXO2THIOXOIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
ETHYL4((2(1(4FLUOROPHENYL)3((4METHOXYPHENYL)METHYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
InChI=1SC28H26FN3O5Sc133727(35)1961021(11719)3025(33)162426(34)32(2212820(29)91322)28(38)31(24)171841423(362)15518h41524H31617H212H3(H3033)
MFCD03941533
ZINC000097995468
ZINC000097995469
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