Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H23N9O4S3.2ClH |
| Molecular Weight | 598.55 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.[H][C@]12SCC(CSC3=NN=NN3CCN(C)C)=C(N1C(=O)[C@H]2NC(=O)CC4=CSC(N)=N4)C(O)=O
InChI
InChIKey=BWRRTAXZCKVRON-DGPOFWGLSA-N
InChI=1S/C18H23N9O4S3.2ClH/c1-25(2)3-4-26-18(22-23-24-26)34-7-9-6-32-15-12(14(29)27(15)13(9)16(30)31)21-11(28)5-10-8-33-17(19)20-10;;/h8,12,15H,3-7H2,1-2H3,(H2,19,20)(H,21,28)(H,30,31);2*1H/t12-,15-;;/m1../s1
Approval Year
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NCI_THESAURUS |
C357
Created by
admin on Fri Dec 15 16:09:30 UTC 2023 , Edited by admin on Fri Dec 15 16:09:30 UTC 2023
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m3206
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DTXSID1045538
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DBSALT000796
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758164
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47896
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100000085999
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266-312-6
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66309-69-1
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31374
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CHEMBL1296
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1098005
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236202
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H7V12WDZ93
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SUB01126MIG
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C65302
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admin on Fri Dec 15 16:09:30 UTC 2023 , Edited by admin on Fri Dec 15 16:09:30 UTC 2023
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ACTIVE MOIETY
SUBSTANCE RECORD