Chemical Components in the PDB

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TFZ : Summary

Code

TFZ

One-letter code

X

Molecule name

N-phenyl-2-(trifluoromethyl)benzamide

Systematic names

ProgramVersionName
OpenEye OEToolkits 1.6.1 N-phenyl-2-(trifluoromethyl)benzamide

Formula

C14 H10 F3 N O

Formal charge

0

Molecular weight

265.231 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.352 FC(F)(F)c1ccccc1C(=O)Nc2ccccc2
SMILES OpenEye OEToolkits 1.7.0 c1ccc(cc1)NC(=O)c2ccccc2C(F)(F)F
Canonical SMILES CACTVS 3.352 FC(F)(F)c1ccccc1C(=O)Nc2ccccc2
Canonical SMILES OpenEye OEToolkits 1.7.0 c1ccc(cc1)NC(=O)c2ccccc2C(F)(F)F

IUPAC InChI

InChI=1S/C14H10F3NO/c15-14(16,17)12-9-5-4-8-11(12)13(19)18-10-6-2-1-3-7-10/h1-9H,(H,18,19)

IUPAC InChI key

ZKPGLQPSAPAFAP-UHFFFAOYSA-N
TFZ

wwPDB Information

Atom count

29 (19 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2010-02-10

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned