Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C27H31N5O5S.CH4O3S |
| Molecular Weight | 633.736 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)N(CC3=CC=C4C=CC(=CC4=C3)C(N)=N)S(=O)(=O)CC(O)=O
InChI
InChIKey=YRIFGKTUAWTSFP-UHFFFAOYSA-N
InChI=1S/C27H31N5O5S.CH4O3S/c1-18(28)31-12-10-25(11-13-31)37-24-8-6-23(7-9-24)32(38(35,36)17-26(33)34)16-19-2-3-20-4-5-21(27(29)30)15-22(20)14-19;1-5(2,3)4/h2-9,14-15,25,28H,10-13,16-17H2,1H3,(H3,29,30)(H,33,34);1H3,(H,2,3,4)
| Molecular Formula | C27H31N5O5S |
| Molecular Weight | 537.631 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 18:19:28 GMT 2025
by
admin
on
Wed Apr 02 18:19:28 GMT 2025
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| Record UNII |
9L44969R9Q
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| Record Status |
Validated (UNII)
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| Record Version |
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209187-02-0
Created by
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9874074
Created by
admin on Wed Apr 02 18:19:28 GMT 2025 , Edited by admin on Wed Apr 02 18:19:28 GMT 2025
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9L44969R9Q
Created by
admin on Wed Apr 02 18:19:28 GMT 2025 , Edited by admin on Wed Apr 02 18:19:28 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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