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2-(4-Chlorophenylamino)-3-(4-chlorophenyl)-1,3,5-triazino[1,2-a]benzimidazole-4-one
SpectraBase Compound ID 1IxwwdnGXE2
InChI InChI=1S/C21H13Cl2N5O/c22-13-5-9-15(10-6-13)24-19-26-20-25-17-3-1-2-4-18(17)28(20)21(29)27(19)16-11-7-14(23)8-12-16/h1-12H,(H,24,25,26)
InChIKey BYBNTDIAPHZXKB-UHFFFAOYSA-N
Mol Weight 422.28 g/mol
Molecular Formula C21H13Cl2N5O
Exact Mass 421.049715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OBgHNz9jW1
Name 2-(4-Chlorophenylamino)-3-(4-chlorophenyl)-1,3,5-triazino[1,2-a]benzimidazole-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13Cl2N5O
InChI InChI=1S/C21H13Cl2N5O/c22-13-5-9-15(10-6-13)24-19-26-20-25-17-3-1-2-4-18(17)28(20)21(29)27(19)16-11-7-14(23)8-12-16/h1-12H,(H,24,25,26)
InChIKey BYBNTDIAPHZXKB-UHFFFAOYSA-N
Molecular Weight 422.275 g/mol
SMILES N(C1=Nc2nc3c([n]2C(N1c1ccc(cc1)Cl)=O)cccc3)c1ccc(cc1)Cl
SPLASH splash10-0w4l-3900100000-071ee498c7689b88d061
Source of Spectrum SO-0-298-5
Synonyms 2-(4-Chloroanilino)-3-(4-chlorophenyl)[1,3,5]triazino[1,2-a]benzimidazol-4(3H)-one
Wiley ID 1543010