3-[[4-(4-oxidanylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-(4-oxidanylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-(4-hydroxy-1-piperidyl)-6-phenyl-pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-(4-hydroxy-1-piperidinyl)-6-phenyl-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-(4-hydroxypiperidin-1-yl)-6-phenylpyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-(4-hydroxypiperidino)-6-phenyl-pyrimidin-2-yl]amino]benzamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1CN(CCC1O)C2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C22H23N5O2/c23-21(29)16-7-4-8-17(13-16)24-22-25-19(15-5-2-1-3-6-15)14-20(26-22)27-11-9-18(28)10-12-27/h1-8,13-14,18,28H,9-12H2,(H2,23,29)(H,24,25,26)