Vitas-M small molecule compound
ethyl 4-(3-[2-(2-fluorophenyl)ethyl]-4-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-5-oxo-2-thioxoimidazolidin-1-yl)benzoate
Catalog ID
STK113169
SMILES CCOC(=O)c1ccc(cc1)N1C(=S)N(C(C1=O)CC(=O)Nc1ccc(cc1)OC)CCc1ccccc1F
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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/c1-3-38-28(36)20-8-12-22(13-9-20)33-27(35)25(18-26(34)31-21-10-14-23(37-2)15-11-21)32(29(33)39)17-16-19-6-4-5-7-24(19)30/h4-15,25H,3,16-18H2,1-2H3,(H,31,34)InChIKey
IVXQBNZAGGPGFV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CCC3=CC=CC=C3F)CC(=O)NC4=CC=C(C=C4)OC
ETHYL4(3(2(2FLUOROPHENYL)ETHYL)4(2((4METHOXYPHENYL)AMINO)2OXOETHYL)5OXO2THIOXOIMIDAZOLIDIN1YL)BENZOATE
ETHYL4(3(2(2FLUOROPHENYL)ETHYL)4(2(4METHOXYANILINO)2OXOETHYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)BENZOATE
InChI=1SC29H28FN3O5Sc133828(36)2081222(13920)3327(35)25(1826(34)3121101423(372)151121)32(29(33)39)171619645724(19)30h41525H31618H212H3(H3134)
MFCD03820382
ZINC000097995482
ZINC000097995483
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