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3-(2-AMINOBENZIMIDAZOL-1-YL)-3-(4-CHLOROPHENYL)-PROPIONIC-ACID-BENZIMIDAZOL-2-YLAMIDINE
SpectraBase Compound ID CNa90fSUtbT
InChI InChI=1S/C23H20ClN7/c24-15-11-9-14(10-12-15)20(31-19-8-4-3-7-18(19)27-22(31)26)13-21(25)30-23-28-16-5-1-2-6-17(16)29-23/h1-12,20H,13H2,(H2,26,27)(H3,25,28,29,30)
InChIKey ZYIZPSHMZGVSJU-UHFFFAOYSA-N
Mol Weight 429.92 g/mol
Molecular Formula C23H20ClN7
Exact Mass 429.146871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ay5RucacFsh
Name 3-(2-amino-1-benzimidazolyl)-N'-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)propanimidamide
Comments Less than 3 mono-isotopic peaks
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Formula C23H20ClN7
InChI InChI=1S/C23H20ClN7/c24-15-11-9-14(10-12-15)20(31-19-8-4-3-7-18(19)27-22(31)26)13-21(25)30-23-28-16-5-1-2-6-17(16)29-23/h1-12,20H,13H2,(H2,26,27)(H3,25,28,29,30)
InChIKey ZYIZPSHMZGVSJU-UHFFFAOYSA-N
Molecular Weight 429.915 g/mol
SMILES N(c1nc2ccccc2[nH]1)C(CC([n]1c(nc2ccccc12)N)c1ccc(cc1)Cl)=N
SPLASH splash10-001i-0900000000-257636fdabf3201c6c4b
Source of Spectrum AJ-42-1115-10
Synonyms 3-(2-aminobenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)propanamidine 3-(2-aminobenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)propanimidamide 3-(2-aminobenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)propionamidine 3-(2-azanylbenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)propanimidamide
Wiley ID 1568170