Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C23H32N6O4S.ClH.3H2O |
| Molecular Weight | 579.11 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.Cl.CCCC1=NC(C)=C2N1NC(=NC2=O)C3=CC(=CC=C3OCC)S(=O)(=O)N4CCN(CC)CC4
InChI
InChIKey=FBCDRHDULQYRTB-UHFFFAOYSA-N
InChI=1S/C23H32N6O4S.ClH.3H2O/c1-5-8-20-24-16(4)21-23(30)25-22(26-29(20)21)18-15-17(9-10-19(18)33-7-3)34(31,32)28-13-11-27(6-2)12-14-28;;;;/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,30);1H;3*1H2
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C2127
Created by
admin on Fri Dec 15 15:38:25 UTC 2023 , Edited by admin on Fri Dec 15 15:38:25 UTC 2023
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DBSALT001741
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m11394
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100000088014
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5M8S2CU0TS
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330808-88-3
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SUB20775
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C76318
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CHEMBL1520
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DTXSID30954704
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SUB23180
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46295
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ACTIVE MOIETY
SUBSTANCE RECORD