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

Systemtic Name: (2S)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-(3-methylbut-2-enoyl)piperidine-2-carboxamide Openeye Name: (2S)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-(3-methylbut-2-enoyl)piperidine-2-carboxamide CAS Name: (2S)-N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-1-(3-methyl-1-oxobut-2-enyl)-2-piperidinecarboxamide IUPAC Name: (2S)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-(3-methylbut-2-enoyl)piperidine-2-carboxamide Traditional Name: (2S)-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-(3-methylbut-2-enoyl)pipecolinamide Formula: C22H28N4O2 MolecularWeight: 380.48332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O2/c1-15(2)13-21(27)25-12-6-5-7-20(25)22(28)23-18-8-10-19(11-9-18)26-17(4)14-16(3)24-26/h8-11,13-14,20H,5-7,12H2,1-4H3,(H,23,28)/t20-/m0/s1