Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H17Cl3N2S.HNO3 |
Molecular Weight | 474.789 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[N+]([O-])=O.ClC1=CC=C(CC[C@H](CN2C=CN=C2)SC3=C(Cl)C=CC=C3Cl)C=C1
InChI
InChIKey=ZHPWRQIPPNZNML-PKLMIRHRSA-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)/t16-;/m1./s1
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 | C19H17Cl3N2S |
Molecular Weight | 411.776 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:07:30 GMT 2023
by
admin
on
Sat Dec 16 11:07:30 GMT 2023
|
Record UNII |
36843F371E
|
Record Status |
Validated (UNII)
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Record Version |
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-
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36843F371E
Created by
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151909-77-2
Created by
admin on Sat Dec 16 11:07:30 GMT 2023 , Edited by admin on Sat Dec 16 11:07:30 GMT 2023
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45266832
Created by
admin on Sat Dec 16 11:07:30 GMT 2023 , Edited by admin on Sat Dec 16 11:07:30 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |