(3S)-1-(cyclohexylmethyl)-6-oxidanylidene-N-[(3-pyrazol-1-ylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(cyclohexylmethyl)-6-oxidanylidene-N-[(3-pyrazol-1-ylphenyl)methyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(cyclohexylmethyl)-6-oxo-N-[(3-pyrazol-1-ylphenyl)methyl]piperidine-3-carboxamide CAS Name: (3S)-1-(cyclohexylmethyl)-6-oxo-N-[[3-(1-pyrazolyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(cyclohexylmethyl)-6-oxo-N-[(3-pyrazol-1-ylphenyl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(cyclohexylmethyl)-6-keto-N-(3-pyrazol-1-ylbenzyl)nipecotamide Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CC(CCC2=O)C(=O)NCC3=CC(=CC=C3)N4C=CC=N4

Isomeric SMILES

C1CCC(CC1)CN2C[C@H](CCC2=O)C(=O)NCC3=CC(=CC=C3)N4C=CC=N4

InChI

InChI=1S/C23H30N4O2/c28-22-11-10-20(17-26(22)16-18-6-2-1-3-7-18)23(29)24-15-19-8-4-9-21(14-19)27-13-5-12-25-27/h4-5,8-9,12-14,18,20H,1-3,6-7,10-11,15-17H2,(H,24,29)/t20-/m0/s1