(2S)-2-[2-(benzotriazol-1-yl)ethanoyl-cyclopropyl-amino]-N-tert-butyl-2-(2-fluorophenyl)ethanamide

Systemtic Name: (2S)-2-[2-(benzotriazol-1-yl)ethanoyl-cyclopropyl-amino]-N-tert-butyl-2-(2-fluorophenyl)ethanamide Openeye Name: (2S)-2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropyl-amino]-N-tert-butyl-2-(2-fluorophenyl)acetamide CAS Name: (2S)-2-[[2-(1-benzotriazolyl)-1-oxoethyl]-cyclopropylamino]-N-tert-butyl-2-(2-fluorophenyl)acetamide IUPAC Name: (2S)-2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropylamino]-N-tert-butyl-2-(2-fluorophenyl)acetamide Traditional Name: (2S)-2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropyl-amino]-N-tert-butyl-2-(2-fluorophenyl)acetamide Formula: C23H26FN5O2 MolecularWeight: 423.483243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CC=C1F)N(C2CC2)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](C1=CC=CC=C1F)N(C2CC2)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H26FN5O2/c1-23(2,3)25-22(31)21(16-8-4-5-9-17(16)24)29(15-12-13-15)20(30)14-28-19-11-7-6-10-18(19)26-27-28/h4-11,15,21H,12-14H2,1-3H3,(H,25,31)/t21-/m0/s1