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Details

Stereochemistry ACHIRAL
Molecular Formula C11H11N5S
Molecular Weight 245.304
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of C-6458

SMILES

NN1C(=S)NN=C1CN2C=CC3=C2C=CC=C3

InChI

InChIKey=PSUJPGZHZCBWOE-UHFFFAOYSA-N
InChI=1S/C11H11N5S/c12-16-10(13-14-11(16)17)7-15-6-5-8-3-1-2-4-9(8)15/h1-6H,7,12H2,(H,14,17)

HIDE SMILES / InChI

Molecular Formula C11H11N5S
Molecular Weight 245.304
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 00:32:28 GMT 2023
Edited
by admin
on Sat Dec 16 00:32:28 GMT 2023
Record UNII
4I5DFQ7EPJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
C-6458
Common Name English
3H-1,2,4-TRIAZOLE-3-THIONE, 4-AMINO-2,4-DIHYDRO-5-(1H-INDOL-1-YLMETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
4I5DFQ7EPJ
Created by admin on Sat Dec 16 00:32:28 GMT 2023 , Edited by admin on Sat Dec 16 00:32:28 GMT 2023
PRIMARY
CAS
478550-49-1
Created by admin on Sat Dec 16 00:32:28 GMT 2023 , Edited by admin on Sat Dec 16 00:32:28 GMT 2023
PRIMARY
PUBCHEM
10354511
Created by admin on Sat Dec 16 00:32:28 GMT 2023 , Edited by admin on Sat Dec 16 00:32:28 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY