4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]benzamide

Systemtic Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]benzamide Openeye Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(3S)-1-pyrimidin-2-yl-3-piperidyl]benzamide CAS Name: 4-[(3,5-dimethyl-1-pyrazolyl)methyl]-N-[(3S)-1-(2-pyrimidinyl)-3-piperidinyl]benzamide IUPAC Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]benzamide Traditional Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(3S)-1-(2-pyrimidyl)-3-piperidyl]benzamide Formula: C22H26N6O MolecularWeight: 390.48144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NC3CCCN(C3)C4=NC=CC=N4)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N[C@H]3CCCN(C3)C4=NC=CC=N4)C

InChI

InChI=1S/C22H26N6O/c1-16-13-17(2)28(26-16)14-18-6-8-19(9-7-18)21(29)25-20-5-3-12-27(15-20)22-23-10-4-11-24-22/h4,6-11,13,20H,3,5,12,14-15H2,1-2H3,(H,25,29)/t20-/m0/s1