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Q5R

Summary
Name:4-(4-phenylpiperazine-1-carbonyl)quinolin-2(1H)-one
Formula:C20 H19 N3 O2
Formal charge:0
Formula weight:333.384 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-(4-phenylpiperazine-1-carbonyl)quinolin-2(1H)-one
OpenEye OEToolkits2.0.74-(4-phenylpiperazin-1-yl)carbonyl-1~{H}-quinolin-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(C1=CC(=O)Nc2ccccc21)N1CCN(CC1)c1ccccc1
InChIInChI1.06InChI=1S/C20H19N3O2/c24-19-14-17(16-8-4-5-9-18(16)21-19)20(25)23-12-10-22(11-13-23)15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,21,24)
InChIKeyInChI1.06NZVVEMCRCLJDCU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O=C1Nc2ccccc2C(=C1)C(=O)N3CCN(CC3)c4ccccc4
SMILESCACTVS3.385O=C1Nc2ccccc2C(=C1)C(=O)N3CCN(CC3)c4ccccc4
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)N2CCN(CC2)C(=O)C3=CC(=O)Nc4c3cccc4
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)N2CCN(CC2)C(=O)C3=CC(=O)Nc4c3cccc4

218853

PDB entries from 2024-04-24

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