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1-[isoquinolin-6-yl-(4-methylthiophen-2-yl)methyl]piperidine-2-carboxylic acid
1-[isoquinolin-6-yl-(4-methylthiophen-2-yl)methyl]piperidine-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CSC(=C1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCCCC4C(=O)O
Isomeric SMILES
CC1=CSC(=C1)C(C2=CC3=C(C=C2)C=NC=C3)N4CCCCC4C(=O)O
InChI
InChI=1S/C21H22N2O2S/c1-14-10-19(26-13-14)20(23-9-3-2-4-18(23)21(24)25)16-5-6-17-12-22-8-7-15(17)11-16/h5-8,10-13,18,20H,2-4,9H2,1H3,(H,24,25)
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