Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C23H16O6.C17H22N2S |
| Molecular Weight | 674.805 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(CN1C2C=CC=CC2SC3=C1C=CC=C3)N(C)C.OC(=O)C4=CC5=C(C=CC=C5)C(CC6=C7C=CC=CC7=CC(C(O)=O)=C6O)=C4O
InChI
InChIKey=JIYNKCRZHNJWRX-UHFFFAOYSA-N
InChI=1S/C23H16O6.C17H22N2S/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19/h1-10,24-25H,11H2,(H,26,27)(H,28,29);4-11,13-14,16H,12H2,1-3H3
| Molecular Formula | C23H16O6 |
| Molecular Weight | 388.3695 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C17H22N2S |
| Molecular Weight | 286.435 |
| Charge | 0 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:23:46 UTC 2023
by
admin
on
Sat Dec 16 19:23:46 UTC 2023
|
| Record UNII |
QC4KTE9PLG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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165412134
Created by
admin on Sat Dec 16 19:23:46 UTC 2023 , Edited by admin on Sat Dec 16 19:23:46 UTC 2023
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PRIMARY | |||
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QC4KTE9PLG
Created by
admin on Sat Dec 16 19:23:46 UTC 2023 , Edited by admin on Sat Dec 16 19:23:46 UTC 2023
|
PRIMARY |
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PARENT -> SALT/SOLVATE |
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