Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C24H30ClN7O4S.C7H8O3S |
| Molecular Weight | 720.259 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.CN(C)C(=O)[C@H]2CC[C@H](NC(=O)C(=O)NC3=NC=C(Cl)C=C3)[C@@H](C2)NC(=O)C4=NC5=C(CN(C)CC5)S4
InChI
InChIKey=ZLFZITWZOYXXAW-QXXZOGQOSA-N
InChI=1S/C24H30ClN7O4S.C7H8O3S/c1-31(2)24(36)13-4-6-15(27-20(33)21(34)30-19-7-5-14(25)11-26-19)17(10-13)28-22(35)23-29-16-8-9-32(3)12-18(16)37-23;1-6-2-4-7(5-3-6)11(8,9)10/h5,7,11,13,15,17H,4,6,8-10,12H2,1-3H3,(H,27,33)(H,28,35)(H,26,30,34);2-5H,1H3,(H,8,9,10)/t13-,15-,17+;/m0./s1
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29750
Created by
admin on Fri Dec 15 16:28:10 UTC 2023 , Edited by admin on Fri Dec 15 16:28:10 UTC 2023
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85975
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100000128250
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m4832
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1599564
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480449-71-6
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C96542
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32W99UE810
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DTXSID10197399
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CHEMBL1269025
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32W99UE810
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XX-18
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44610678
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SUB35059
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DBSALT001717
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ACTIVE MOIETY
SUBSTANCE RECORD