Details
Stereochemistry | RACEMIC |
Molecular Formula | C19H15F3N4O3.C7H8O3S |
Molecular Weight | 576.544 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.NC2CCN(C2)C3=NC4=C(C=C3F)C(=O)C(=CN4C5=C(F)C=C(F)C=C5)C(O)=O
InChI
InChIKey=CSSQVOKOWWIUCX-UHFFFAOYSA-N
InChI=1S/C19H15F3N4O3.C7H8O3S/c20-9-1-2-15(13(21)5-9)26-8-12(19(28)29)16(27)11-6-14(22)18(24-17(11)26)25-4-3-10(23)7-25;1-6-2-4-7(5-3-6)11(8,9)10/h1-2,5-6,8,10H,3-4,7,23H2,(H,28,29);2-5H,1H3,(H,8,9,10)
Approval Year
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C795
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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Code System | Code | Type | Description | ||
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NO6NM634EH
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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DTXSID8047842
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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CHEMBL273348
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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m10984
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | Merck Index | ||
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77605
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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100000084639
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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115964-29-9
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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C76234
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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SUB04924MIG
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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C055185
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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93858
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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PRIMARY | |||
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100490-94-6
Created by
admin on Fri Dec 15 16:06:50 UTC 2023 , Edited by admin on Fri Dec 15 16:06:50 UTC 2023
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NON-SPECIFIC STOICHIOMETRY |
ACTIVE MOIETY
SUBSTANCE RECORD