Details
Stereochemistry | ACHIRAL |
Molecular Formula | C21H19N5O2.2CH4O3S |
Molecular Weight | 565.619 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CS(O)(=O)=O.NC(=N)C1=CC2=C(C=C1)C=C(OC(=O)C3=CC=C(NC4=NCCN4)C=C3)C=C2
InChI
InChIKey=ICYICMXERRTCPY-UHFFFAOYSA-N
InChI=1S/C21H19N5O2.2CH4O3S/c22-19(23)16-2-1-15-12-18(8-5-14(15)11-16)28-20(27)13-3-6-17(7-4-13)26-21-24-9-10-25-21;2*1-5(2,3)4/h1-8,11-12H,9-10H2,(H3,22,23)(H2,24,25,26);2*1H3,(H,2,3,4)
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C21H19N5O2 |
Molecular Weight | 373.4079 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:07:34 UTC 2023
by
admin
on
Fri Dec 15 18:07:34 UTC 2023
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Record UNII |
8MW790BPKQ
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Record Status |
Validated (UNII)
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Record Version |
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-
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6918061
Created by
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103926-82-5
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admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
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C058875
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admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
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8MW790BPKQ
Created by
admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
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m925
Created by
admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
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PRIMARY | Merck Index | ||
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DTXSID50908668
Created by
admin on Fri Dec 15 18:07:35 UTC 2023 , Edited by admin on Fri Dec 15 18:07:35 UTC 2023
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PARENT -> SALT/SOLVATE |
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