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1-morpholin-4-yl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
1-morpholin-4-yl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
C1CCN(CC1)C(=O)CSC2=NC(=C3CCCCC3=C2C#N)N4CCOCC4
Isomeric SMILES
C1CCN(CC1)C(=O)CSC2=NC(=C3CCCCC3=C2C#N)N4CCOCC4
InChI
InChI=1S/C21H28N4O2S/c22-14-18-16-6-2-3-7-17(16)20(25-10-12-27-13-11-25)23-21(18)28-15-19(26)24-8-4-1-5-9-24/h1-13,15H2
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