Vitas-M small molecule compound
ethyl 4-[4-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-3-(4-fluorobenzyl)-5-oxo-2-thioxoimidazolidin-1-yl]benzoate
Catalog ID
STK095116
SMILES CCOc1ccc(cc1)NC(=O)CC1N(Cc2ccc(cc2)F)C(=S)N(C1=O)c1ccc(cc1)C(=O)OCC
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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 C29H28FN3O5S MW 549.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN3O5S/c1-3-37-24-15-11-22(12-16-24)31-26(34)17-25-27(35)33(23-13-7-20(8-14-23)28(36)38-4-2)29(39)32(25)18-19-5-9-21(30)10-6-19/h5-16,25H,3-4,17-18H2,1-2H3,(H,31,34)InChIKey
VFQMWZWWYORHEA-UHFFFAOYSA-NSynonyms
1024020-98-11024020981
CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC=C(C=C3)F)C4=CC=C(C=C4)C(=O)OCC
CCOc1ccc(cc1)NC(=O)CC1N(Cc2ccc(cc2)F)C(=S)N(C1=O)c1ccc(cc1)C(=O)OCC
ETHYL4(4(2((4ETHOXYPHENYL)AMINO)2OXOETHYL)3(4FLUOROBENZYL)5OXO2THIOXOIMIDAZOLIDIN1YL)BENZOATE
ETHYL4(4(2(4ETHOXYANILINO)2OXOETHYL)3((4FLUOROPHENYL)METHYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)BENZOATE
InChI=1SC29H28FN3O5Sc133724151122(121624)3126(34)172527(35)33(2313720(81423)28(36)3842)29(39)32(25)18195921(30)10619h51625H341718H212H3(H3134)
MFCD02142257
STK095116
ZINC000097952004
ZINC000097952005
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