N-(3-chloranyl-4-fluoranyl-phenyl)-1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-1-[(1-cyclopentyl-5-benzotriazolyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)isonipecotamide Formula: C24H25ClFN5O2 MolecularWeight: 469.939003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)N4CCC(CC4)C(=O)NC5=CC(=C(C=C5)F)Cl)N=N2

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)N4CCC(CC4)C(=O)NC5=CC(=C(C=C5)F)Cl)N=N2

InChI

InChI=1S/C24H25ClFN5O2/c25-19-14-17(6-7-20(19)26)27-23(32)15-9-11-30(12-10-15)24(33)16-5-8-22-21(13-16)28-29-31(22)18-3-1-2-4-18/h5-8,13-15,18H,1-4,9-12H2,(H,27,32)