N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-5-bromanyl-2-fluoranyl-benzamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-5-bromanyl-2-fluoranyl-benzamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-5-bromo-2-fluoro-benzamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-5-bromo-2-fluorobenzamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-5-bromo-2-fluorobenzamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-5-bromo-2-fluoro-benzamide Formula: C22H17BrFN3O MolecularWeight: 438.292283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NC3=CC=CC=C3N2)NC(=O)C4=C(C=CC(=C4)Br)F

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C2=NC3=CC=CC=C3N2)NC(=O)C4=C(C=CC(=C4)Br)F

InChI

InChI=1S/C22H17BrFN3O/c23-15-10-11-17(24)16(13-15)22(28)27-20(12-14-6-2-1-3-7-14)21-25-18-8-4-5-9-19(18)26-21/h1-11,13,20H,12H2,(H,25,26)(H,27,28)/t20-/m0/s1