N-(3-bromophenyl)-1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-bromophenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)piperidine-4-carboxamide CAS Name: N-(3-bromophenyl)-1-[(1-cyclopentyl-5-benzotriazolyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-bromophenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)isonipecotamide Formula: C24H26BrN5O2 MolecularWeight: 496.39954

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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(=CC=C5)Br)N=N2

Isomeric SMILES

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

InChI

InChI=1S/C24H26BrN5O2/c25-18-4-3-5-19(15-18)26-23(31)16-10-12-29(13-11-16)24(32)17-8-9-22-21(14-17)27-28-30(22)20-6-1-2-7-20/h3-5,8-9,14-16,20H,1-2,6-7,10-13H2,(H,26,31)