(3S)-1-(1-benzofuran-2-ylmethyl)-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(1-benzofuran-2-ylmethyl)-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzofuran-2-ylmethyl)-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(2-benzofuranylmethyl)-N-[3-(1-pyrazolyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(1-benzofuran-2-ylmethyl)-N-(3-pyrazol-1-ylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(benzofuran-2-ylmethyl)-N-(3-pyrazol-1-ylphenyl)nipecotamide Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC3=CC=CC=C3O2)C(=O)NC4=CC=CC(=C4)N5C=CC=N5

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=CC3=CC=CC=C3O2)C(=O)NC4=CC=CC(=C4)N5C=CC=N5

InChI

InChI=1S/C24H24N4O2/c29-24(26-20-8-3-9-21(15-20)28-13-5-11-25-28)19-7-4-12-27(16-19)17-22-14-18-6-1-2-10-23(18)30-22/h1-3,5-6,8-11,13-15,19H,4,7,12,16-17H2,(H,26,29)/t19-/m0/s1