Details
Stereochemistry | RACEMIC |
Molecular Formula | C19H17Cl3N2S.HNO3 |
Molecular Weight | 474.789 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[N+]([O-])=O.ClC1=CC=C(CCC(CN2C=CN=C2)SC3=C(Cl)C=CC=C3Cl)C=C1
InChI
InChIKey=ZHPWRQIPPNZNML-UHFFFAOYSA-N
InChI=1S/C19H17Cl3N2S.HNO3/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22;2-1(3)4/h1-5,7-8,10-11,13,16H,6,9,12H2;(H,2,3,4)
Approval Year
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C514
Created by
admin on Fri Dec 15 18:59:54 UTC 2023 , Edited by admin on Fri Dec 15 18:59:54 UTC 2023
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64872-77-1
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CHEMBL1295
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47471
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C47427
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47464
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DB00639
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DTXSID6045452
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100000084860
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4805237NP5
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4805237NP5
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1082300
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m2801
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admin on Fri Dec 15 18:59:53 UTC 2023 , Edited by admin on Fri Dec 15 18:59:53 UTC 2023
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3241
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SUB00918MIG
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ACTIVE MOIETY
SUBSTANCE RECORD