Details
Stereochemistry | RACEMIC |
Molecular Formula | C24H20Cl2N2OS.HNO3 |
Molecular Weight | 518.412 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[N+]([O-])=O.ClC1=CC(Cl)=C(C=C1)C(CN2C=CN=C2)OCC3=CC=C(SC4=CC=CC=C4)C=C3
InChI
InChIKey=FJNRUWDGCVDXLU-UHFFFAOYSA-N
InChI=1S/C24H20Cl2N2OS.HNO3/c25-19-8-11-22(23(26)14-19)24(15-28-13-12-27-17-28)29-16-18-6-9-21(10-7-18)30-20-4-2-1-3-5-20;2-1(3)4/h1-14,17,24H,15-16H2;(H,2,3,4)
Molecular Formula | HNO3 |
Molecular Weight | 63.0128 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C24H20Cl2N2OS |
Molecular Weight | 455.399 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:31:57 UTC 2023
by
admin
on
Fri Dec 15 15:31:57 UTC 2023
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Record UNII |
8V4JGC8YRF
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C514
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m5302
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277-302-6
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83606
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DTXSID30993890
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73151-29-8
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SUB13831MIG
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8V4JGC8YRF
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100000091096
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236229
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C81508
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CHEMBL1651990
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51754
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PARENT -> SALT/SOLVATE |
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IMPURITY -> PARENT |
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PARENT -> IMPURITY |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
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ACTIVE MOIETY |