Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C23H21N5O3S.C7H8O3S |
| Molecular Weight | 619.711 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.CN2C=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)N4C=CC(\C=C\C(=O)NC5=CC=CC=C5N)=C4
InChI
InChIKey=IAVXAZDVNICKFJ-ICSBZGNSSA-N
InChI=1S/C23H21N5O3S.C7H8O3S/c1-27-16-19(14-25-27)18-7-9-20(10-8-18)32(30,31)28-13-12-17(15-28)6-11-23(29)26-22-5-3-2-4-21(22)24;1-6-2-4-7(5-3-6)11(8,9)10/h2-16H,24H2,1H3,(H,26,29);2-5H,1H3,(H,8,9,10)/b11-6+;
| Molecular Formula | C23H21N5O3S |
| Molecular Weight | 447.51 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C7H8O3S |
| Molecular Weight | 172.202 |
| 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
Sat Dec 16 14:35:57 UTC 2023
by
admin
on
Sat Dec 16 14:35:57 UTC 2023
|
| Record UNII |
9PW28FR8VD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
9PW28FR8VD
Created by
admin on Sat Dec 16 14:35:57 UTC 2023 , Edited by admin on Sat Dec 16 14:35:57 UTC 2023
|
PRIMARY | |||
|
44217246
Created by
admin on Sat Dec 16 14:35:57 UTC 2023 , Edited by admin on Sat Dec 16 14:35:57 UTC 2023
|
PRIMARY | |||
|
1186222-89-8
Created by
admin on Sat Dec 16 14:35:57 UTC 2023 , Edited by admin on Sat Dec 16 14:35:57 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ACTIVE MOIETY |
|