Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H20N2S.C14H10O4 |
| Molecular Weight | 526.646 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | C17 H20 N2 S |
SHOW SMILES / InChI
SMILES
OC(=O)C1=CC=CC=C1C(=O)C2=CC=C(O)C=C2.CC(CN3C4=C(SC5=C3C=CC=C5)C=CC=C4)N(C)C
InChI
InChIKey=WCYMACWVZQIWLM-UHFFFAOYSA-N
InChI=1S/C17H20N2S.C14H10O4/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19;15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h4-11,13H,12H2,1-3H3;1-8,15H,(H,17,18)
Approval Year
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96590-75-9
Created by
admin on Sat Dec 16 08:30:16 UTC 2023 , Edited by admin on Sat Dec 16 08:30:16 UTC 2023
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71449006
Created by
admin on Sat Dec 16 08:30:16 UTC 2023 , Edited by admin on Sat Dec 16 08:30:16 UTC 2023
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SUB126766
Created by
admin on Sat Dec 16 08:30:16 UTC 2023 , Edited by admin on Sat Dec 16 08:30:16 UTC 2023
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100000152986
Created by
admin on Sat Dec 16 08:30:16 UTC 2023 , Edited by admin on Sat Dec 16 08:30:16 UTC 2023
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27EM8884DE
Created by
admin on Sat Dec 16 08:30:16 UTC 2023 , Edited by admin on Sat Dec 16 08:30:16 UTC 2023
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ACTIVE MOIETY
METABOLITE (PARENT)
METABOLITE (PARENT)
SUBSTANCE RECORD
