1-[4-[[4-(4-oxidanylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]amino]phenyl]ethanone hydrochloride

Systemtic Name: 1-[4-[[4-(4-oxidanylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]amino]phenyl]ethanone hydrochloride Openeye Name: 1-[4-[[4-(4-hydroxy-1-piperidyl)-6-phenyl-pyrimidin-2-yl]amino]phenyl]ethanone hydrochloride CAS Name: 1-[4-[[4-(4-hydroxy-1-piperidinyl)-6-phenyl-2-pyrimidinyl]amino]phenyl]ethanone hydrochloride IUPAC Name: 1-[4-[[4-(4-hydroxypiperidin-1-yl)-6-phenylpyrimidin-2-yl]amino]phenyl]ethanone hydrochloride Traditional Name: 1-[4-[[4-(4-hydroxypiperidino)-6-phenyl-pyrimidin-2-yl]amino]phenyl]ethanone hydrochloride Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC2=NC(=CC(=N2)N3CCC(CC3)O)C4=CC=CC=C4.Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC2=NC(=CC(=N2)N3CCC(CC3)O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C23H24N4O2.ClH/c1-16(28)17-7-9-19(10-8-17)24-23-25-21(18-5-3-2-4-6-18)15-22(26-23)27-13-11-20(29)12-14-27;/h2-10,15,20,29H,11-14H2,1H3,(H,24,25,26);1H