N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(3-fluorophenyl)methyl]-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(3-fluorophenyl)methyl]-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(3-fluorophenyl)methyl]-6-oxo-piperidine-3-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-1-[(3-fluorophenyl)methyl]-6-oxo-3-piperidinecarboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(3-fluorophenyl)methyl]-6-oxopiperidine-3-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-(3-fluorobenzyl)-6-keto-nipecotamide Formula: C21H27FN4O2 MolecularWeight: 386.463083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2CCC(=O)N(C2)CC3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2CCC(=O)N(C2)CC3=CC(=CC=C3)F)C

InChI

InChI=1S/C21H27FN4O2/c1-15-11-16(2)26(24-15)10-4-9-23-21(28)18-7-8-20(27)25(14-18)13-17-5-3-6-19(22)12-17/h3,5-6,11-12,18H,4,7-10,13-14H2,1-2H3,(H,23,28)