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4-(2-Chlorophenyl)-6-keto-2-thioxo-hexahydropyrimidine-5-carbonitrile
SpectraBase Compound ID 2xYlI7B1HFT
InChI InChI=1S/C11H8ClN3OS/c12-8-4-2-1-3-6(8)9-7(5-13)10(16)15-11(17)14-9/h1-4,7,9H,(H2,14,15,16,17)
InChIKey ULYCEHMONOXEDW-UHFFFAOYSA-N
Mol Weight 265.72 g/mol
Molecular Formula C11H8ClN3OS
Exact Mass 265.007661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1xjFK8p7MO
Name 4-(2-Chlorophenyl)-6-keto-2-thioxo-hexahydropyrimidine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8ClN3OS
InChI InChI=1S/C11H8ClN3OS/c12-8-4-2-1-3-6(8)9-7(5-13)10(16)15-11(17)14-9/h1-4,7,9H,(H2,14,15,16,17)
InChIKey ULYCEHMONOXEDW-UHFFFAOYSA-N
Molecular Weight 265.718 g/mol
SMILES N1C(NC(c2c(Cl)cccc2)C(C1=O)C#N)=S
SPLASH splash10-00kr-1960000000-409b2514fc878319b1cb
Source of Spectrum G2-34-2629-4
Synonyms Pyrimidine-5-carboxamide, hexahydro-4-(2-chlorophenyl)-6-oxo-2-thioxo- 4-(2-Chlorophenyl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-5-carbonitrile 4-(2-Chlorophenyl)-6-oxo-2-sulfanylidene-1,3-diazinane-5-carbonitrile 4-(2-Chlorophenyl)-6-oxo-2-thioxo-hexahydropyrimidine-5-carbonitrile 4-(2-Chlorophenyl)-6-oxo-2-thioxohexahydro-5-pyrimidinecarbonitrile
Wiley ID 1582448