Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C13H11ClN4OS.CH4O3S |
Molecular Weight | 402.876 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.C[C@H](SC1=NC(N)=CC(Cl)=N1)C2=NC=C3OC=CC3=C2
InChI
InChIKey=DACCRIAOWPHTII-FJXQXJEOSA-N
InChI=1S/C13H11ClN4OS.CH4O3S/c1-7(20-13-17-11(14)5-12(15)18-13)9-4-8-2-3-19-10(8)6-16-9;1-5(2,3)4/h2-7H,1H3,(H2,15,17,18);1H3,(H,2,3,4)/t7-;/m0./s1
Molecular Formula | C13H11ClN4OS |
Molecular Weight | 306.771 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
PubMed
Title | Date | PubMed |
---|---|---|
(-)-6-Chloro-2-[(1-furo[2, 3-c]pyridin-5-ylethyl)thio]-4-pyrimidinamine, PNU-142721, a new broad spectrum HIV-1 non-nucleoside reverse transcriptase inhibitor. | 1998 Apr 23 |
|
Structural basis for the inhibitory efficacy of efavirenz (DMP-266), MSC194 and PNU142721 towards the HIV-1 RT K103N mutant. | 2002 Mar |
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:47:48 UTC 2023
by
admin
on
Fri Dec 15 15:47:48 UTC 2023
|
Record UNII |
7QH6XJ3PLD
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Code | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Code | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
7QH6XJ3PLD
Created by
admin on Fri Dec 15 15:47:48 UTC 2023 , Edited by admin on Fri Dec 15 15:47:48 UTC 2023
|
PRIMARY | |||
|
131842441
Created by
admin on Fri Dec 15 15:47:48 UTC 2023 , Edited by admin on Fri Dec 15 15:47:48 UTC 2023
|
PRIMARY | |||
|
185220-05-7
Created by
admin on Fri Dec 15 15:47:48 UTC 2023 , Edited by admin on Fri Dec 15 15:47:48 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |