2-[4-[(3-azanylpyrrolidin-1-yl)methyl]-2-fluoranyl-phenyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[(3-azanylpyrrolidin-1-yl)methyl]-2-fluoranyl-phenyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[(3-aminopyrrolidin-1-yl)methyl]-2-fluoro-phenyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[(3-amino-1-pyrrolidinyl)methyl]-2-fluorophenyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[(3-aminopyrrolidin-1-yl)methyl]-2-fluorophenyl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[(3-aminopyrrolidino)methyl]-2-fluoro-phenyl]-1H-benzimidazole-4-carboxamide Formula: C19H20FN5O MolecularWeight: 353.393403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)CC2=CC(=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)F

Isomeric SMILES

C1CN(CC1N)CC2=CC(=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)F

InChI

InChI=1S/C19H20FN5O/c20-15-8-11(9-25-7-6-12(21)10-25)4-5-13(15)19-23-16-3-1-2-14(18(22)26)17(16)24-19/h1-5,8,12H,6-7,9-10,21H2,(H2,22,26)(H,23,24)