2-[4-[(cyclohexylamino)methyl]-2-fluoranyl-phenyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[(cyclohexylamino)methyl]-2-fluoranyl-phenyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[(cyclohexylamino)methyl]-2-fluoro-phenyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[(cyclohexylamino)methyl]-2-fluorophenyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[(cyclohexylamino)methyl]-2-fluorophenyl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[(cyclohexylamino)methyl]-2-fluoro-phenyl]-1H-benzimidazole-4-carboxamide Formula: C21H23FN4O MolecularWeight: 366.431923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC2=CC(=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)F

Isomeric SMILES

C1CCC(CC1)NCC2=CC(=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)F

InChI

InChI=1S/C21H23FN4O/c22-17-11-13(12-24-14-5-2-1-3-6-14)9-10-15(17)21-25-18-8-4-7-16(20(23)27)19(18)26-21/h4,7-11,14,24H,1-3,5-6,12H2,(H2,23,27)(H,25,26)