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N-(2-(4-Chlorophenyl)-4-oxothiazolidin-3-yl)-2-(6-iodo-4-oxo-2-phenylquinazolin-3(4H)-yloxy)acetamide
SpectraBase Compound ID CFdQi9vQ6q6
InChI InChI=1S/C25H18ClIN4O4S/c26-17-8-6-16(7-9-17)25-30(22(33)14-36-25)29-21(32)13-35-31-23(15-4-2-1-3-5-15)28-20-11-10-18(27)12-19(20)24(31)34/h1-12,25H,13-14H2,(H,29,32)
InChIKey RFVMGODIZMAQAI-UHFFFAOYSA-N
Mol Weight 632.86 g/mol
Molecular Formula C25H18ClIN4O4S
Exact Mass 631.978199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLmDHBFAAUV
Name N-(2-(4-Chlorophenyl)-4-oxothiazolidin-3-yl)-2-(6-iodo-4-oxo-2-phenylquinazolin-3(4H)-yloxy)acetamide
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H18ClIN4O4S
InChI InChI=1S/C25H18ClIN4O4S/c26-17-8-6-16(7-9-17)25-30(22(33)14-36-25)29-21(32)13-35-31-23(15-4-2-1-3-5-15)28-20-11-10-18(27)12-19(20)24(31)34/h1-12,25H,13-14H2,(H,29,32)
InChIKey RFVMGODIZMAQAI-UHFFFAOYSA-N
Instrument Name Shimadzu QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4096
Molecular Weight 632.860 g/mol
SMILES N(N1C(CSC1c1ccc(Cl)cc1)=O)C(CON1C(=Nc2c(C1=O)cc(cc2)I)c1ccccc1)=O
SPLASH splash10-0002-0009000000-7d3662220e42dce84618
Source of Spectrum Y-57-3902-5
Wiley ID 1859881