(3S)-N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-cyclopentyl-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-cyclopentyl-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: (3S)-N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-cyclopentyl-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-cyclopentyl-6-oxo-3-piperidinecarboxamide IUPAC Name: (3S)-N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-cyclopentyl-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-cyclopentyl-6-keto-nipecotamide Formula: C21H25ClN4O2 MolecularWeight: 400.9018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CC(CCC2=O)C(=O)NCC3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(C1)N2C[C@H](CCC2=O)C(=O)NCC3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H25ClN4O2/c22-17-8-5-14(6-9-17)20-16(12-24-25-20)11-23-21(28)15-7-10-19(27)26(13-15)18-3-1-2-4-18/h5-6,8-9,12,15,18H,1-4,7,10-11,13H2,(H,23,28)(H,24,25)/t15-/m0/s1