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S-[2-[2-(4-fluorophenyl)ethyl-(3-pyridin-4-ylpropylcarbamoyl)amino]ethyl] ethanethioate
S-[2-[2-(4-fluorophenyl)ethyl-(3-pyridin-4-ylpropylcarbamoyl)amino]ethyl] ethanethioate
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)SCCN(CCC1=CC=C(C=C1)F)C(=O)NCCCC2=CC=NC=C2
Isomeric SMILES
CC(=O)SCCN(CCC1=CC=C(C=C1)F)C(=O)NCCCC2=CC=NC=C2
InChI
InChI=1S/C21H26FN3O2S/c1-17(26)28-16-15-25(14-10-19-4-6-20(22)7-5-19)21(27)24-11-2-3-18-8-12-23-13-9-18/h4-9,12-13H,2-3,10-11,14-16H2,1H3,(H,24,27)
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