2-[2-(benzotriazol-1-yl)ethanoyl-cyclopropyl-amino]-N-(4-fluorophenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-cyclopropyl-amino]-N-(4-fluorophenyl)-2-phenyl-ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropyl-amino]-N-(4-fluorophenyl)-2-phenyl-acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-cyclopropylamino]-N-(4-fluorophenyl)-2-phenylacetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropylamino]-N-(4-fluorophenyl)-2-phenylacetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropyl-amino]-N-(4-fluorophenyl)-2-phenyl-acetamide Formula: C25H22FN5O2 MolecularWeight: 443.472883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CC1N(C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C25H22FN5O2/c26-18-10-12-19(13-11-18)27-25(33)24(17-6-2-1-3-7-17)31(20-14-15-20)23(32)16-30-22-9-5-4-8-21(22)28-29-30/h1-13,20,24H,14-16H2,(H,27,33)