(3S)-N-(phenylmethyl)-1-[1-(1H-pyrazol-4-ylcarbonyl)piperidin-4-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-N-(phenylmethyl)-1-[1-(1H-pyrazol-4-ylcarbonyl)piperidin-4-yl]piperidine-3-carboxamide Openeye Name: (3S)-N-benzyl-1-[1-(1H-pyrazole-4-carbonyl)-4-piperidyl]piperidine-3-carboxamide CAS Name: (3S)-1-[1-[oxo(1H-pyrazol-4-yl)methyl]-4-piperidinyl]-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-benzyl-1-[1-(1H-pyrazole-4-carbonyl)piperidin-4-yl]piperidine-3-carboxamide Traditional Name: (3S)-N-benzyl-1-[1-(1H-pyrazole-4-carbonyl)-4-piperidyl]nipecotamide Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CCN(CC2)C(=O)C3=CNN=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C2CCN(CC2)C(=O)C3=CNN=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H29N5O2/c28-21(23-13-17-5-2-1-3-6-17)18-7-4-10-27(16-18)20-8-11-26(12-9-20)22(29)19-14-24-25-15-19/h1-3,5-6,14-15,18,20H,4,7-13,16H2,(H,23,28)(H,24,25)/t18-/m0/s1