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Details

Stereochemistry ACHIRAL
Molecular Formula C28H32N9
Molecular Weight 494.614
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of N,N-DIMETHYL-2-(5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOL-3-YL)-N-(2-(5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOL-3-YL)ETHYL)ETHANAMINIUM

SMILES

C[N+](C)(CCC1=CNC2=C1C=C(CN3C=NC=N3)C=C2)CCC4=CNC5=C4C=C(CN6C=NC=N6)C=C5

InChI

InChIKey=JSDBPIAUZAHBLO-UHFFFAOYSA-N
InChI=1S/C28H32N9/c1-37(2,9-7-23-13-31-27-5-3-21(11-25(23)27)15-35-19-29-17-33-35)10-8-24-14-32-28-6-4-22(12-26(24)28)16-36-20-30-18-34-36/h3-6,11-14,17-20,31-32H,7-10,15-16H2,1-2H3/q+1

HIDE SMILES / InChI

Molecular Formula C28H32N9
Molecular Weight 494.614
Charge 1
Count
Stereochemistry RACEMIC
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 08:13:25 UTC 2023
Edited
by admin
on Sat Dec 16 08:13:25 UTC 2023
Record UNII
Z30567690Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-DIMETHYL-2-(5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOL-3-YL)-N-(2-(5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOL-3-YL)ETHYL)ETHANAMINIUM
Systematic Name English
RIZATRIPTAN BENZOATE IMPURITY B [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
76963086
Created by admin on Sat Dec 16 08:13:25 UTC 2023 , Edited by admin on Sat Dec 16 08:13:25 UTC 2023
PRIMARY
FDA UNII
Z30567690Z
Created by admin on Sat Dec 16 08:13:25 UTC 2023 , Edited by admin on Sat Dec 16 08:13:25 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
EP