Details
Stereochemistry | RACEMIC |
Molecular Formula | C22H29N3S2.2C4H6O5 |
Molecular Weight | 667.791 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(CC(O)=O)C(O)=O.OC(CC(O)=O)C(O)=O.CCSC1=CC2=C(SC3=C(C=CC=C3)N2CCCN4CCN(C)CC4)C=C1
InChI
InChIKey=GTHHLZDYRHLACN-UHFFFAOYSA-N
InChI=1S/C22H29N3S2.2C4H6O5/c1-3-26-18-9-10-22-20(17-18)25(19-7-4-5-8-21(19)27-22)12-6-11-24-15-13-23(2)14-16-24;2*5-2(4(8)9)1-3(6)7/h4-5,7-10,17H,3,6,11-16H2,1-2H3;2*2,5H,1H2,(H,6,7)(H,8,9)
Approval Year
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29710
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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NCI_THESAURUS |
C740
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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Code System | Code | Type | Description | ||
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257-780-2
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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HP46XK89XB
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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DBSALT001328
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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SUB126078
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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32216
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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C66598
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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CHEMBL1378
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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SUB71452
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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100000151687
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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52239-63-1
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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11954258
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | |||
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71529
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | RxNorm | ||
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m10737
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY | Merck Index | ||
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DTXSID1045586
Created by
admin on Fri Dec 15 16:21:20 UTC 2023 , Edited by admin on Fri Dec 15 16:21:20 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD