(2S)-1-(3-acetamidopropanoyl)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-2-carboxamide

Systemtic Name: (2S)-1-(3-acetamidopropanoyl)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-2-carboxamide Openeye Name: (2S)-1-(3-acetamidopropanoyl)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-2-carboxamide CAS Name: (2S)-1-(3-acetamido-1-oxopropyl)-N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-2-piperidinecarboxamide IUPAC Name: (2S)-1-(3-acetamidopropanoyl)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-2-carboxamide Traditional Name: (2S)-1-(3-acetamidopropanoyl)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]pipecolinamide Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)C3CCCCN3C(=O)CCNC(=O)C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)[C@@H]3CCCCN3C(=O)CCNC(=O)C)C

InChI

InChI=1S/C22H29N5O3/c1-15-14-16(2)27(25-15)19-9-7-18(8-10-19)24-22(30)20-6-4-5-13-26(20)21(29)11-12-23-17(3)28/h7-10,14,20H,4-6,11-13H2,1-3H3,(H,23,28)(H,24,30)/t20-/m0/s1