Details
Stereochemistry | ACHIRAL |
Molecular Formula | C17H20N4S.C7H6O2 |
Molecular Weight | 434.554 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C1=CC=CC=C1.CN2CCN(CC2)C3=NC4=CC=CC=C4NC5=C3C=C(C)S5
InChI
InChIKey=CQCVGXWYFQCZKX-UHFFFAOYSA-N
InChI=1S/C17H20N4S.C7H6O2/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12;8-7(9)6-4-2-1-3-5-6/h3-6,11,19H,7-10H2,1-2H3;1-5H,(H,8,9)
Molecular Formula | C17H20N4S |
Molecular Weight | 312.432 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C7H6O2 |
Molecular Weight | 122.1213 |
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 16:13:53 GMT 2023
by
admin
on
Fri Dec 15 16:13:53 GMT 2023
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Record UNII |
BC164W3V2U
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Record Status |
Validated (UNII)
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Record Version |
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-
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BC164W3V2U
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135524955
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SUB179067
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100000164604
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861390-70-7
Created by
admin on Fri Dec 15 16:13:53 GMT 2023 , Edited by admin on Fri Dec 15 16:13:53 GMT 2023
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