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2-((1H-Benzo[d]imidazol-2-yl)methylthio)-4-chloro-6-phenylpyrimidine-5-carbonitrile
SpectraBase Compound ID JyK8qd76ZTY
InChI InChI=1S/C19H12ClN5S/c20-18-13(10-21)17(12-6-2-1-3-7-12)24-19(25-18)26-11-16-22-14-8-4-5-9-15(14)23-16/h1-9H,11H2,(H,22,23)
InChIKey FMPUMVVGQUGVBT-UHFFFAOYSA-N
Mol Weight 377.85 g/mol
Molecular Formula C19H12ClN5S
Exact Mass 377.050194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CllkFJgjNdf
Name 2-((1H-Benzo[d]imidazol-2-yl)methylthio)-4-chloro-6-phenylpyrimidine-5-carbonitrile
Alternate Name(s) 2-(1H-benzimidazol-2-ylmethylthio)-4-chloro-6-phenyl-5-pyrimidinecarbonitrile 2-(1H-benzimidazol-2-ylmethylsulfanyl)-4-chloro-6-phenylpyrimidine-5-carbonitrile 2-(1H-benzimidazol-2-ylmethylsulfanyl)-4-chloro-6-phenyl-pyrimidine-5-carbonitrile 2-(1H-benzimidazol-2-ylmethylsulfanyl)-4-chloranyl-6-phenyl-pyrimidine-5-carbonitrile
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Formula C19H12ClN5S
InChI InChI=1S/C19H12ClN5S/c20-18-13(10-21)17(12-6-2-1-3-7-12)24-19(25-18)26-11-16-22-14-8-4-5-9-15(14)23-16/h1-9H,11H2,(H,22,23)
InChIKey FMPUMVVGQUGVBT-UHFFFAOYSA-N
Molecular Weight 377.853 g/mol
SMILES [nH]1c2ccccc2nc1CSc1nc(c(C#N)c(n1)-c1ccccc1)Cl
SPLASH splash10-00b9-0069000000-d0fa747eae9d9639030d
Source of Spectrum F2-45-2341-4
Wiley ID 1689200