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

Systemtic Name: 1-[(2-azanylpyrimidin-5-yl)methyl]-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(2-aminopyrimidin-5-yl)methyl]-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(2-amino-5-pyrimidinyl)methyl]-N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-aminopyrimidin-5-yl)methyl]-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-[(2-aminopyrimidin-5-yl)methyl]-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]isonipecotamide Formula: C22H27N7O MolecularWeight: 405.49608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)C3CCN(CC3)CC4=CN=C(N=C4)N)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)C3CCN(CC3)CC4=CN=C(N=C4)N)C

InChI

InChI=1S/C22H27N7O/c1-15-11-16(2)29(27-15)20-5-3-19(4-6-20)26-21(30)18-7-9-28(10-8-18)14-17-12-24-22(23)25-13-17/h3-6,11-13,18H,7-10,14H2,1-2H3,(H,26,30)(H2,23,24,25)