Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H23N5O4S |
Molecular Weight | 441.503 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(C(C)=NO1)C2=CC(O[C@H]3CCNC3)=C(C=C2)C4=CC(C(N)=O)=C(NC(N)=O)S4
InChI
InChIKey=NMFIXEFNQPDISY-ZDUSSCGKSA-N
InChI=1S/C21H23N5O4S/c1-10-18(11(2)30-26-10)12-3-4-14(16(7-12)29-13-5-6-24-9-13)17-8-15(19(22)27)20(31-17)25-21(23)28/h3-4,7-8,13,24H,5-6,9H2,1-2H3,(H2,22,27)(H3,23,25,28)/t13-/m0/s1
Molecular Formula | C21H23N5O4S |
Molecular Weight | 441.503 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL2111328 Sources: https://pubs.acs.org/doi/abs/10.1021/op500105n |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:06:04 GMT 2023
by
admin
on
Sat Dec 16 15:06:04 GMT 2023
|
Record UNII |
2TT3S8GPB7
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Code | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Systematic Name | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
1609281-86-8
Created by
admin on Sat Dec 16 15:06:04 GMT 2023 , Edited by admin on Sat Dec 16 15:06:04 GMT 2023
|
PRIMARY | |||
|
91666658
Created by
admin on Sat Dec 16 15:06:04 GMT 2023 , Edited by admin on Sat Dec 16 15:06:04 GMT 2023
|
PRIMARY | |||
|
2TT3S8GPB7
Created by
admin on Sat Dec 16 15:06:04 GMT 2023 , Edited by admin on Sat Dec 16 15:06:04 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |