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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13F3N2.ClH
Molecular Weight 326.744
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RO-5-4933

SMILES

Cl.FC(F)(F)C1=CC=C2NCCN=C(C3=CC=CC=C3)C2=C1

InChI

InChIKey=FWRWZHRENRIJRW-UHFFFAOYSA-N
InChI=1S/C16H13F3N2.ClH/c17-16(18,19)12-6-7-14-13(10-12)15(21-9-8-20-14)11-4-2-1-3-5-11;/h1-7,10,20H,8-9H2;1H

HIDE SMILES / InChI

Molecular Formula C16H13F3N2
Molecular Weight 290.283
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:20:44 UTC 2023
Edited
by admin
on Fri Dec 15 15:20:44 UTC 2023
Record UNII
8RVH55M9P5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RO-5-4933
Code English
1H-1,4-BENZODIAZEPINE, 2,3-DIHYDRO-5-PHENYL-7-(TRIFLUOROMETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
7-TRIFLUOROMETHYL-5-PHENYL-1,2-DIHYDRO(3H)-1,4-BENZODIAZEPINE HYDROCHLORIDE
Systematic Name English
1H-1,4-BENZODIAZEPINE, 2,3-DIHYDRO-5-PHENYL-7-(TRIFLUOROMETHYL)-, MONOHYDROCHLORIDE
Common Name English
Code System Code Type Description
PUBCHEM
133082982
Created by admin on Fri Dec 15 15:20:44 UTC 2023 , Edited by admin on Fri Dec 15 15:20:44 UTC 2023
PRIMARY
CAS
2898-18-2
Created by admin on Fri Dec 15 15:20:44 UTC 2023 , Edited by admin on Fri Dec 15 15:20:44 UTC 2023
PRIMARY
FDA UNII
8RVH55M9P5
Created by admin on Fri Dec 15 15:20:44 UTC 2023 , Edited by admin on Fri Dec 15 15:20:44 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE