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Q1R

Summary
Name:5-chloranyl-~{N}3-phenyl-~{N}1-(phenylmethyl)benzene-1,3-dicarboxamide
Formula:C21 H17 Cl N2 O2
Formal charge:0
Formula weight:364.825 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits3.1.0.05-chloranyl-~{N}3-phenyl-~{N}1-(phenylmethyl)benzene-1,3-dicarboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C21H17ClN2O2/c22-18-12-16(20(25)23-14-15-7-3-1-4-8-15)11-17(13-18)21(26)24-19-9-5-2-6-10-19/h1-13H,14H2,(H,23,25)(H,24,26)
InChIKeyInChI1.06YLFDFYBJVIURMX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1cc(cc(c1)C(=O)Nc2ccccc2)C(=O)NCc3ccccc3
SMILESCACTVS3.385Clc1cc(cc(c1)C(=O)Nc2ccccc2)C(=O)NCc3ccccc3
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1ccc(cc1)CNC(=O)c2cc(cc(c2)Cl)C(=O)Nc3ccccc3
SMILESOpenEye OEToolkits3.1.0.0c1ccc(cc1)CNC(=O)c2cc(cc(c2)Cl)C(=O)Nc3ccccc3

221051

PDB entries from 2024-06-12

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