Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C19H18ClN3O5S.C16H20N2 |
| Molecular Weight | 1112.106 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C(CNCC1=CC=CC=C1)NCC2=CC=CC=C2.[H][C@]34SC(C)(C)[C@@H](N3C(=O)[C@H]4NC(=O)C5=C(C)ON=C5C6=CC=CC=C6Cl)C(O)=O.[H][C@]78SC(C)(C)[C@@H](N7C(=O)[C@H]8NC(=O)C9=C(C)ON=C9C%10=CC=CC=C%10Cl)C(O)=O
InChI
InChIKey=COCFKSXGORCFOW-VZHMHXRYSA-N
InChI=1S/2C19H18ClN3O5S.C16H20N2/c2*1-8-11(12(22-28-8)9-6-4-5-7-10(9)20)15(24)21-13-16(25)23-14(18(26)27)19(2,3)29-17(13)23;1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h2*4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27);1-10,17-18H,11-14H2/t2*13-,14+,17-;/m11./s1
Approval Year
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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CFR |
21 CFR 526.464B
Created by
admin on Fri Dec 15 15:37:12 UTC 2023 , Edited by admin on Fri Dec 15 15:37:12 UTC 2023
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NCI_THESAURUS |
C1500
Created by
admin on Fri Dec 15 15:37:12 UTC 2023 , Edited by admin on Fri Dec 15 15:37:12 UTC 2023
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CFR |
21 CFR 526.464A
Created by
admin on Fri Dec 15 15:37:12 UTC 2023 , Edited by admin on Fri Dec 15 15:37:12 UTC 2023
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| Code System | Code | Type | Description | ||
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245-855-2
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AC79L7PV2G
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PRIMARY | |||
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C006692
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DBSALT001648
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300000017672
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PRIMARY | |||
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C76854
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DTXSID101020014
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CHEMBL891
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64706
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m3673
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admin on Fri Dec 15 15:37:12 UTC 2023 , Edited by admin on Fri Dec 15 15:37:12 UTC 2023
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PRIMARY | Merck Index | ||
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AC79L7PV2G
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1141909
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1043213
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51351
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23736-58-5
Created by
admin on Fri Dec 15 15:37:12 UTC 2023 , Edited by admin on Fri Dec 15 15:37:12 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD
