2-[(4-cyano-1-piperidin-1-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]ethanamide

Systemtic Name: 2-[(4-cyano-1-piperidin-1-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-cyano-1-(1-piperidyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-cyano-1-(1-piperidinyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]thio]acetamide IUPAC Name: 2-[(4-cyano-1-piperidin-1-yl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-cyano-1-piperidino-5,6,7,8-tetrahydroisoquinolin-3-yl)thio]acetamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3CCCCC3=C(C(=N2)SCC(=O)N)C#N

Isomeric SMILES

C1CCN(CC1)C2=C3CCCCC3=C(C(=N2)SCC(=O)N)C#N

InChI

InChI=1S/C17H22N4OS/c18-10-14-12-6-2-3-7-13(12)16(21-8-4-1-5-9-21)20-17(14)23-11-15(19)22/h1-9,11H2,(H2,19,22)