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2-(4-Chloranylphenoxy)-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide
SpectraBase Compound ID C7QqBYLuKnR
InChI InChI=1S/C16H12ClN3O3S/c17-10-5-7-11(8-6-10)23-9-14(21)19-20-15(22)12-3-1-2-4-13(12)18-16(20)24/h1-8H,9H2,(H,18,24)(H,19,21)
InChIKey HZGAKATWVHKJNI-UHFFFAOYSA-N
Mol Weight 361.8 g/mol
Molecular Formula C16H12ClN3O3S
Exact Mass 361.02879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0gOoi1NVCe
Name 2-(4-Chloranylphenoxy)-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide
Alternate Name(s) 2-(4-Chlorophenoxy)-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)acetamide 2-(4-Chlorophenoxy)-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide 2-(4-Chlorophenoxy)-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)acetamide
CAS Registry Number 120049-10-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClN3O3S
InChI InChI=1S/C16H12ClN3O3S/c17-10-5-7-11(8-6-10)23-9-14(21)19-20-15(22)12-3-1-2-4-13(12)18-16(20)24/h1-8H,9H2,(H,18,24)(H,19,21)
InChIKey HZGAKATWVHKJNI-UHFFFAOYSA-N
Molecular Weight 361.803 g/mol
SMILES N1c2c(C(N(C1=S)NC(=O)COc1ccc(cc1)Cl)=O)cccc2
SPLASH splash10-003r-1951000000-eec447d72baf88e66b9a
Source of Spectrum O-23-670-6
Wiley ID 1348866