Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H19N5O4S2.H2O |
| Molecular Weight | 463.531 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.C\C=C/C1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)C3=CC=C4N=C(N)SC4=C3)C2=O)C(O)=O
InChI
InChIKey=IOKIMKWTGZVJPY-HERYOFLYSA-N
InChI=1S/C19H19N5O4S2.H2O/c1-2-3-9-7-29-17-13(16(26)24(17)14(9)18(27)28)23-15(25)12(20)8-4-5-10-11(6-8)30-19(21)22-10;/h2-6,12-13,17H,7,20H2,1H3,(H2,21,22)(H,23,25)(H,27,28);1H2/b3-2-;/t12-,13-,17-;/m1./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
|
Code | English | ||
|
Preferred Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
131842269
Created by
admin on Mon Mar 31 21:26:30 GMT 2025 , Edited by admin on Mon Mar 31 21:26:30 GMT 2025
|
PRIMARY | |||
|
9F4O89Z826
Created by
admin on Mon Mar 31 21:26:30 GMT 2025 , Edited by admin on Mon Mar 31 21:26:30 GMT 2025
|
PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD