Vitas-M small molecule compound
ethyl 4-[({1-benzyl-5-oxo-3-[4-(2-oxopyrrolidin-1-yl)benzyl]-2-thioxoimidazolidin-4-yl}acetyl)amino]benzoate
Catalog ID
STK662847
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CC1N(Cc2ccc(cc2)N2CCCC2=O)C(=S)N(C1=O)Cc1ccccc1
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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 C32H32N4O5S MW 584.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O5S/c1-2-41-31(40)24-12-14-25(15-13-24)33-28(37)19-27-30(39)36(21-22-7-4-3-5-8-22)32(42)35(27)20-23-10-16-26(17-11-23)34-18-6-9-29(34)38/h3-5,7-8,10-17,27H,2,6,9,18-21H2,1H3,(H,33,37)InChIKey
QKMPNXLHQZHNLR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC=C(C=C3)N4CCCC4=O)CC5=CC=CC=C5
ethyl4(((1benzyl5oxo3(4(2oxopyrrolidin1yl)benzyl)2thioxoimidazolidin4yl)acetyl)amino)benzoate
ETHYL4((2(1BENZYL5OXO3((4(2OXOPYRROLIDIN1YL)PHENYL)METHYL)2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
InChI=1SC32H32N4O5Sc124131(40)24121425(151324)3328(37)192730(39)36(21227435822)32(42)35(27)2023101626(171123)34186929(34)38h3578101727H2691821H21H3(H3337)
MFCD03768707
ZINC000098005201
ZINC000098005202
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