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Details

Stereochemistry ACHIRAL
Molecular Formula C17H20ClN5
Molecular Weight 329.827
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-CHLORO-5-METHYL-11-(4-METHYLPIPERAZIN-1-YL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE

SMILES

CN1CCN(CC1)C2=NC3=CC(Cl)=CC=C3N(C)N4C=CC=C24

InChI

InChIKey=MOECFFAOWNUOML-UHFFFAOYSA-N
InChI=1S/C17H20ClN5/c1-20-8-10-22(11-9-20)17-16-4-3-7-23(16)21(2)15-6-5-13(18)12-14(15)19-17/h3-7,12H,8-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C17H20ClN5
Molecular Weight 329.827
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 Sat Dec 16 13:44:37 UTC 2023
Edited
by admin
on Sat Dec 16 13:44:37 UTC 2023
Record UNII
9BC5X7Z06A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-CHLORO-5-METHYL-11-(4-METHYLPIPERAZIN-1-YL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE
Systematic Name English
5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE, 8-CHLORO-5-METHYL-11-(4-METHYL-1-PIPERAZINYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
20458730
Created by admin on Sat Dec 16 13:44:37 UTC 2023 , Edited by admin on Sat Dec 16 13:44:37 UTC 2023
PRIMARY
FDA UNII
9BC5X7Z06A
Created by admin on Sat Dec 16 13:44:37 UTC 2023 , Edited by admin on Sat Dec 16 13:44:37 UTC 2023
PRIMARY
CAS
79700-39-3
Created by admin on Sat Dec 16 13:44:37 UTC 2023 , Edited by admin on Sat Dec 16 13:44:37 UTC 2023
PRIMARY