Details
Stereochemistry | RACEMIC |
Molecular Formula | C16H17N3O2S |
Molecular Weight | 315.39 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC2=C(NC(=N2)[S+]([O-])CC3=NC=C(C)C=C3C)C=C1
InChI
InChIKey=ZMXZYNHJPJEPAE-UHFFFAOYSA-N
InChI=1S/C16H17N3O2S/c1-10-6-11(2)15(17-8-10)9-22(20)16-18-13-5-4-12(21-3)7-14(13)19-16/h4-8H,9H2,1-3H3,(H,18,19)
Molecular Formula | C16H17N3O2S |
Molecular Weight | 315.39 |
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
Edited
Mon Mar 31 22:58:45 GMT 2025
by
admin
on
Mon Mar 31 22:58:45 GMT 2025
|
Record UNII |
0S4HQG5KFN
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Common Name | English | ||
|
Preferred Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
46781146
Created by
admin on Mon Mar 31 22:58:45 GMT 2025 , Edited by admin on Mon Mar 31 22:58:45 GMT 2025
|
PRIMARY | |||
|
110374-16-8
Created by
admin on Mon Mar 31 22:58:45 GMT 2025 , Edited by admin on Mon Mar 31 22:58:45 GMT 2025
|
PRIMARY | |||
|
1A00060
Created by
admin on Mon Mar 31 22:58:45 GMT 2025 , Edited by admin on Mon Mar 31 22:58:45 GMT 2025
|
PRIMARY | |||
|
0S4HQG5KFN
Created by
admin on Mon Mar 31 22:58:45 GMT 2025 , Edited by admin on Mon Mar 31 22:58:45 GMT 2025
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> IMPURITY | |||
|
PARENT -> IMPURITY |