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Benzamide, N-[4-(4-chlorophenyl)-2-thioxo-1(2H)-pyrimidinyl]-
SpectraBase Compound ID 73yBlgpsYs4
InChI InChI=1S/C17H12ClN3OS/c18-14-8-6-12(7-9-14)15-10-11-21(17(23)19-15)20-16(22)13-4-2-1-3-5-13/h1-11H,(H,20,22)
InChIKey NPLOHJMDPHRGCN-UHFFFAOYSA-N
Mol Weight 341.82 g/mol
Molecular Formula C17H12ClN3OS
Exact Mass 341.038961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWLfiyW14OU
Name Benzamide, N-[4-(4-chlorophenyl)-2-thioxo-1(2H)-pyrimidinyl]-
CAS Registry Number 85164-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClN3OS
InChI InChI=1S/C17H12ClN3OS/c18-14-8-6-12(7-9-14)15-10-11-21(17(23)19-15)20-16(22)13-4-2-1-3-5-13/h1-11H,(H,20,22)
InChIKey NPLOHJMDPHRGCN-UHFFFAOYSA-N
Molecular Weight 341.816 g/mol
SMILES N(N1C(N=C(c2ccc(cc2)Cl)C=C1)=S)C(=O)c1ccccc1
SPLASH splash10-0pb9-4910000000-1c5178eea0a315a5569e
Source of Spectrum AH-120-753-2
Synonyms 1-Benzoylamino-4-(p-chlorophenyl)-2-thioxopyrimidine N-(4-(4-chlorophenyl)-2-thioxo-1(2H)-pyrimidinyl)benzamide
Wiley ID 1335816