1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(1-cyclopentylbenzotriazole-5-carbonyl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(1-cyclopentyl-5-benzotriazolyl)-oxomethyl]-N-[(4-fluorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1-cyclopentylbenzotriazole-5-carbonyl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(1-cyclopentylbenzotriazole-5-carbonyl)-N-(4-fluorobenzyl)isonipecotamide Formula: C25H28FN5O2 MolecularWeight: 449.520523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)N4CCC(CC4)C(=O)NCC5=CC=C(C=C5)F)N=N2

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)N4CCC(CC4)C(=O)NCC5=CC=C(C=C5)F)N=N2

InChI

InChI=1S/C25H28FN5O2/c26-20-8-5-17(6-9-20)16-27-24(32)18-11-13-30(14-12-18)25(33)19-7-10-23-22(15-19)28-29-31(23)21-3-1-2-4-21/h5-10,15,18,21H,1-4,11-14,16H2,(H,27,32)