3-azanyl-5-[2-oxidanyl-5-(phenylmethyl)phenyl]-1-piperidin-3-yl-pyrazin-2-one

Systemtic Name: 3-azanyl-5-[2-oxidanyl-5-(phenylmethyl)phenyl]-1-piperidin-3-yl-pyrazin-2-one Openeye Name: 3-amino-5-(5-benzyl-2-hydroxy-phenyl)-1-(3-piperidyl)pyrazin-2-one CAS Name: 3-amino-5-[2-hydroxy-5-(phenylmethyl)phenyl]-1-(3-piperidinyl)-2-pyrazinone IUPAC Name: 3-amino-5-(5-benzyl-2-hydroxyphenyl)-1-piperidin-3-ylpyrazin-2-one Traditional Name: 3-amino-5-(5-benzyl-2-hydroxy-phenyl)-1-(3-piperidyl)pyrazin-2-one Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C(C=CC(=C3)CC4=CC=CC=C4)O

Isomeric SMILES

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C(C=CC(=C3)CC4=CC=CC=C4)O

InChI

InChI=1S/C22H24N4O2/c23-21-22(28)26(17-7-4-10-24-13-17)14-19(25-21)18-12-16(8-9-20(18)27)11-15-5-2-1-3-6-15/h1-3,5-6,8-9,12,14,17,24,27H,4,7,10-11,13H2,(H2,23,25)