2-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazin-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]-1-piperazinyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazin-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazino]-N-(3-fluorophenyl)acetamide Formula: C26H25FN6O2 MolecularWeight: 472.514103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C26H25FN6O2/c27-21-4-3-5-22(16-21)28-25(34)18-31-12-14-32(15-13-31)26(35)20-10-8-19(9-11-20)17-33-24-7-2-1-6-23(24)29-30-33/h1-11,16H,12-15,17-18H2,(H,28,34)