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2-[3-[2-(1-adamantyloxy)ethyl]-1-(4-chlorophenyl)-5-keto-2-thioxo-imidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide
SpectraBase Compound ID 1ZP7W17y6lJ
InChI InChI=1S/C32H38ClN3O4S/c1-2-12-39-27-9-5-25(6-10-27)34-29(37)17-28-30(38)36(26-7-3-24(33)4-8-26)31(41)35(28)11-13-40-32-18-21-14-22(19-32)16-23(15-21)20-32/h3-10,21-23,28H,2,11-20H2,1H3,(H,34,37)/t21-,22+,23-,28?,32-
InChIKey VANYQRWUGJECKC-TXJCJKAHSA-N
Mol Weight 596.2 g/mol
Molecular Formula C32H38ClN3O4S
Exact Mass 595.227156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uXdkfhagoD
Name 2-[3-[2-(1-adamantyloxy)ethyl]-1-(4-chlorophenyl)-5-keto-2-thioxo-imidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H38ClN3O4S
InChI InChI=1S/C32H38ClN3O4S/c1-2-12-39-27-9-5-25(6-10-27)34-29(37)17-28-30(38)36(26-7-3-24(33)4-8-26)31(41)35(28)11-13-40-32-18-21-14-22(19-32)16-23(15-21)20-32/h3-10,21-23,28H,2,11-20H2,1H3,(H,34,37)/t21-,22+,23-,28?,32-
InChIKey VANYQRWUGJECKC-TXJCJKAHSA-N
Molecular Weight 596.186 g/mol
SMILES N(C(CC1C(N(C(N1CCOC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=S)c1ccc(cc1)Cl)=O)=O)c1ccc(cc1)OCCC
SPLASH splash10-000i-7910100000-3a876d18e4d53300ce1a
Synonyms 2-[3-[2-(1-adamantyloxy)ethyl]-1-(4-chlorophenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-(4-propoxyphenyl)ethanamide 2-[3-[2-(1-adamantyloxy)ethyl]-1-(4-chlorophenyl)-5-oxo-2-sulfanylidene-4-imidazolidinyl]-N-(4-propoxyphenyl)acetamide 2-[3-[2-(1-adamantyloxy)ethyl]-1-(4-chlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide 2-[3-[2-(1-adamantyloxy)ethyl]-1-(4-chlorophenyl)-5-oxo-2-thioxo-imidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide
Wiley ID 1464519