(3S)-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-6-oxo-1-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-N-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-6-oxo-1-[2-(2-pyridinyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-6-oxo-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-6-keto-1-[2-(2-pyridyl)ethyl]nipecotamide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=O)C2CCC(=O)N(C2)CCC3=CC=CC=N3)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=O)[C@H]2CCC(=O)N(C2)CCC3=CC=CC=N3)C

InChI

InChI=1S/C21H29N5O2/c1-4-26-16(3)19(15(2)24-26)13-23-21(28)17-8-9-20(27)25(14-17)12-10-18-7-5-6-11-22-18/h5-7,11,17H,4,8-10,12-14H2,1-3H3,(H,23,28)/t17-/m0/s1