(3S)-N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxidanylidene-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxidanylidene-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide CAS Name: (3S)-N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxo-N-[2-(1-pyrazolyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-keto-N-(2-pyrazol-1-ylethyl)nipecotamide Formula: C21H27FN4O2 MolecularWeight: 386.463083

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN1C=CC=N1)C(=O)C2CCC(=O)N(C2)CCC3=CC(=CC=C3)F

Isomeric SMILES

CCN(CCN1C=CC=N1)C(=O)[C@H]2CCC(=O)N(C2)CCC3=CC(=CC=C3)F

InChI

InChI=1S/C21H27FN4O2/c1-2-24(13-14-26-11-4-10-23-26)21(28)18-7-8-20(27)25(16-18)12-9-17-5-3-6-19(22)15-17/h3-6,10-11,15,18H,2,7-9,12-14,16H2,1H3/t18-/m0/s1