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2-(2,5-Dichlorophenoxy)-N-(4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl)acetamide
SpectraBase Compound ID 7HZV0ET3fjG
InChI InChI=1S/C16H11Cl2N3O3S/c17-9-5-6-11(18)13(7-9)24-8-14(22)20-21-15(23)10-3-1-2-4-12(10)19-16(21)25/h1-7H,8H2,(H,19,25)(H,20,22)
InChIKey AHXPJIPCAWSSAM-UHFFFAOYSA-N
Mol Weight 396.25 g/mol
Molecular Formula C16H11Cl2N3O3S
Exact Mass 394.989818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAdbh87yIbm
Name 2-(2,5-Dichlorophenoxy)-N-(4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl)acetamide
CAS Registry Number 120049-07-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11Cl2N3O3S
InChI InChI=1S/C16H11Cl2N3O3S/c17-9-5-6-11(18)13(7-9)24-8-14(22)20-21-15(23)10-3-1-2-4-12(10)19-16(21)25/h1-7H,8H2,(H,19,25)(H,20,22)
InChIKey AHXPJIPCAWSSAM-UHFFFAOYSA-N
Molecular Weight 396.248 g/mol
SMILES SC1=Nc2ccccc2C(N1NC(COc1cc(ccc1Cl)Cl)=O)=O
SPLASH splash10-03e9-3960000000-d5af7e2913fba409c0b4
Source of Spectrum O-23-670-3
Synonyms 2-(2,5-dichlorophenoxy)-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)acetamide 2-(2,5-dichlorophenoxy)-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide 2-(2,5-dichlorophenoxy)-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)acetamide 2-[2,5-bis(chloranyl)phenoxy]-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide N-(2-Thioxo-4-oxo-1,2,3,4-tetrahydroquinazolin-3-yl)-2-(2,5-dichlorophenoxy)-acetamide
Wiley ID 1366959