N-[3-cyano-4-[4-(4-oxidanylpiperidin-1-yl)piperidin-1-yl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(4-oxidanylpiperidin-1-yl)piperidin-1-yl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide Openeye Name: N-[3-cyano-4-[4-(4-hydroxy-1-piperidyl)-1-piperidyl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-[4-(4-hydroxy-1-piperidinyl)-1-piperidinyl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide IUPAC Name: N-[3-cyano-4-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide Traditional Name: N-[3-cyano-4-[4-(4-hydroxypiperidino)piperidino]phenyl]-5-methyl-1H-pyrazole-4-carboxamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C(=O)NC2=CC(=C(C=C2)N3CCC(CC3)N4CCC(CC4)O)C#N

Isomeric SMILES

CC1=C(C=NN1)C(=O)NC2=CC(=C(C=C2)N3CCC(CC3)N4CCC(CC4)O)C#N

InChI

InChI=1S/C22H28N6O2/c1-15-20(14-24-26-15)22(30)25-17-2-3-21(16(12-17)13-23)28-8-4-18(5-9-28)27-10-6-19(29)7-11-27/h2-3,12,14,18-19,29H,4-11H2,1H3,(H,24,26)(H,25,30)