(3S)-6-oxidanylidene-N-[2-(1-phenylpyrazol-4-yl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-6-oxidanylidene-N-[2-(1-phenylpyrazol-4-yl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-6-oxo-N-[2-(1-phenylpyrazol-4-yl)ethyl]-1-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-6-oxo-N-[2-(1-phenyl-4-pyrazolyl)ethyl]-1-[2-(2-pyridinyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-6-oxo-N-[2-(1-phenylpyrazol-4-yl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-N-[2-(1-phenylpyrazol-4-yl)ethyl]-1-[2-(2-pyridyl)ethyl]nipecotamide Formula: C24H27N5O2 MolecularWeight: 417.50348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)CCC4=CC=CC=N4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)CCC4=CC=CC=N4

InChI

InChI=1S/C24H27N5O2/c30-23-10-9-20(18-28(23)15-12-21-6-4-5-13-25-21)24(31)26-14-11-19-16-27-29(17-19)22-7-2-1-3-8-22/h1-8,13,16-17,20H,9-12,14-15,18H2,(H,26,31)/t20-/m0/s1