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propan-2-yl 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]ethanoate
propan-2-yl 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]ethanoate
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)OC(=O)CSC1=NC2=C(CCCCC2)C=C1C#N
Isomeric SMILES
CC(C)OC(=O)CSC1=NC2=C(CCCCC2)C=C1C#N
InChI
InChI=1S/C16H20N2O2S/c1-11(2)20-15(19)10-21-16-13(9-17)8-12-6-4-3-5-7-14(12)18-16/h8,11H,3-7,10H2,1-2H3
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