Chemical Components in the PDB

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5FZ : Summary

Code

5FZ

One-letter code

X

Molecule name

~{N}-(3-ethyl-6-methoxy-1,2-benzoxazol-5-yl)-4-methoxy-benzenesulfonamide

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 ~{N}-(3-ethyl-6-methoxy-1,2-benzoxazol-5-yl)-4-methoxy-benzenesulfonamide

Formula

C17 H18 N2 O5 S

Formal charge

0

Molecular weight

362.4 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CCc1noc2cc(OC)c(N[S](=O)(=O)c3ccc(OC)cc3)cc12
SMILES OpenEye OEToolkits 2.0.7 CCc1c2cc(c(cc2on1)OC)NS(=O)(=O)c3ccc(cc3)OC
Canonical SMILES CACTVS 3.385 CCc1noc2cc(OC)c(N[S](=O)(=O)c3ccc(OC)cc3)cc12
Canonical SMILES OpenEye OEToolkits 2.0.7 CCc1c2cc(c(cc2on1)OC)NS(=O)(=O)c3ccc(cc3)OC

IUPAC InChI

InChI=1S/C17H18N2O5S/c1-4-14-13-9-15(17(23-3)10-16(13)24-18-14)19-25(20,21)12-7-5-11(22-2)6-8-12/h5-10,19H,4H2,1-3H3

IUPAC InChI key

QDPZIJXJBVSBJA-UHFFFAOYSA-N
5FZ

wwPDB Information

Atom count

43 (25 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2021-08-17

Last modified at

2022-08-12

Status

Released

Obsoleted

Not Assigned