benzetimide (Q27274534)

Benzetimide (English)

14 October 2016

chemical formula

C₂₃H₂₆N₂O₂

1 reference

Benzetimide (English)

14 October 2016

canonical SMILES

C1CN(CCC1C2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=CC=C4

1 reference

Benzetimide (English)

InChI=1S/C23H26N2O2/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,24,26,27)

14 October 2016

Identifiers

InChI

1 reference

Benzetimide (English)

LQQIVYSCPWCSSD-UHFFFAOYSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

Benzetimide (English)

14 October 2016

1 reference

UNII

B987T0L5FX

benzetimide (English)

14 October 2016

1 reference

Benzetimide (English)

14 October 2016

1 reference

Benzetimide (English)

14 October 2016

ChEBI ID

188883

mapping relation type

exact match

1 reference

stated in

ChEBI release 2022-06-13

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

BENZETIMIDE (English)

14 October 2016

1 reference

1 reference

DSSTOX compound identifier

DTXCID0026173

0 references

Human Metabolome Database ID

HMDB0248988

1 reference

based on heuristic

inferred from InChIKey

UNII

B987T0L5FX

1 reference

stated in

Global Substance Registration System

UNII

B987T0L5FX

benzetimide (English)