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3-(2-AMINOBENZIMIDAZOL-1-YL)-3-PHENYLPROPIONIC-ACID-BENZIMIDAZOL-2-YLAMIDINE
SpectraBase Compound ID ICgG4iezVwQ
InChI InChI=1S/C23H21N7/c24-21(29-23-27-16-10-4-5-11-17(16)28-23)14-20(15-8-2-1-3-9-15)30-19-13-7-6-12-18(19)26-22(30)25/h1-13,20H,14H2,(H2,25,26)(H3,24,27,28,29)
InChIKey HWSVRJKMAAWNHP-UHFFFAOYSA-N
Mol Weight 395.47 g/mol
Molecular Formula C23H21N7
Exact Mass 395.185844 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JW7UGyWtDj5
Name 3-(2-amino-1-benzimidazolyl)-N'-(1H-benzimidazol-2-yl)-3-phenylpropanimidamide
Alternate Name(s) 3-(2-aminobenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-phenyl-propanamidine 3-(2-aminobenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-phenyl-propionamidine 3-(2-aminobenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-phenylpropanimidamide 3-(2-azanylbenzimidazol-1-yl)-N'-(1H-benzimidazol-2-yl)-3-phenyl-propanimidamide
Comments Less than 3 mono-isotopic peaks
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Formula C23H21N7
InChI InChI=1S/C23H21N7/c24-21(29-23-27-16-10-4-5-11-17(16)28-23)14-20(15-8-2-1-3-9-15)30-19-13-7-6-12-18(19)26-22(30)25/h1-13,20H,14H2,(H2,25,26)(H3,24,27,28,29)
InChIKey HWSVRJKMAAWNHP-UHFFFAOYSA-N
Molecular Weight 395.470 g/mol
SMILES N(c1nc2ccccc2[nH]1)C(CC([n]1c(nc2ccccc12)N)c1ccccc1)=N
SPLASH splash10-03e9-0590000000-f1e430286f63e261ee85
Source of Spectrum AJ-42-1115-10
Wiley ID 1568171