(Q27076820)

CHEMBL2164575 (English)

3 October 2016

chemical formula

C₂₅H₂₆F₃N₃O₂S

1 reference

CHEMBL2164575 (English)

3 October 2016

canonical SMILES

CC1=C(C2=C(C=C1)NC3=C(CN2S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C=CC(=N3)C(F)(F)F)C

1 reference

CHEMBL2164575 (English)

InChI=1S/C25H26F3N3O2S/c1-15-6-12-20-22(16(15)2)31(14-17-7-13-21(25(26,27)28)30-23(17)29-20)34(32,33)19-10-8-18(9-11-19)24(3,4)5/h6-13H,14H2,1-5H3,(H,29,30)

3 October 2016

Identifiers

InChI

1 reference

CHEMBL2164575 (English)

OAIVSBLLDFJYMS-UHFFFAOYSA-N

3 October 2016

InChIKey

1 reference

CHEMBL2164575 (English)

3 October 2016

1 reference

(6S)-6-(4-tert-butylphenyl)sulfonyl-7,8-dimethyl-2-(trifluoromethyl)-5,11-dihydropyrido[3,2-c][1,5]benzodiazepine (English)

3 October 2016

2 references

CHEMBL2164575 (English)

matched by identifier from

3 October 2016

InChIKey

OAIVSBLLDFJYMS-UHFFFAOYSA-N

1 reference

Guide to Pharmacology Ligand ID

CHEMBL2164575 (English)

3 October 2016

1 reference

8503

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

8503

compound 8a [PMID: 24900283] (English)