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2-(1H-benzoimidazol-2-yl)-3-[1-(4-fluoro-phenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-acrylonitrile, hydrochloride
SpectraBase Compound ID 9guekjnx35h
InChI InChI=1S/C22H17FN4.ClH/c1-14-11-16(15(2)27(14)19-9-7-18(23)8-10-19)12-17(13-24)22-25-20-5-3-4-6-21(20)26-22;/h3-12H,1-2H3,(H,25,26);1H/b17-12+;
InChIKey AWEMYBLFGOYGLT-KCUXUEJTSA-N
Mol Weight 392.87 g/mol
Molecular Formula C22H18ClFN4
Exact Mass 392.120402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12sZ5vprWTh
Name 2-(1H-benzoimidazol-2-yl)-3-[1-(4-fluoro-phenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-acrylonitrile, hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClFN4
InChI InChI=1S/C22H17FN4.ClH/c1-14-11-16(15(2)27(14)19-9-7-18(23)8-10-19)12-17(13-24)22-25-20-5-3-4-6-21(20)26-22;/h3-12H,1-2H3,(H,25,26);1H/b17-12+;
InChIKey AWEMYBLFGOYGLT-KCUXUEJTSA-N
Molecular Weight 392.865 g/mol
SMILES Cl.[nH]1c2ccccc2nc1\C(=C\c1c([n](-c2ccc(cc2)F)c(c1)C)C)C#N
SPLASH splash10-0a4i-7849000000-06e1f1be6d1a78dfc910
Synonyms (2E)-2-(1H-1,3-benzodiazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]prop-2-enenitrile hydrochloride (E)-2-(1H-benzimidazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenenitrile hydrochloride (E)-2-(1H-benzimidazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]acrylonitrile hydrochloride (E)-2-(1H-benzimidazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile hydrochloride (E)-2-(1H-benzimidazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenenitrile;hydrochloride (E)-2-(1H-benzimidazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enenitrile;hydrochloride (E)-2-(1H-benzimidazol-2-yl)-3-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile;hydrochloride
Wiley ID 1453654