1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-(thian-4-yl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-(thian-4-yl)piperidin-4-yl]propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-tetrahydrothiopyran-4-yl-4-piperidyl)propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-(4-thianyl)-4-piperidinyl]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-(thian-4-yl)piperidin-4-yl]propan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-tetrahydrothiopyran-4-yl-4-piperidyl)propan-1-one Formula: C22H32N2OS MolecularWeight: 372.56728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)N2CCC3=CC=CC=C3C2)C4CCSCC4

Isomeric SMILES

C1CN(CCC1CCC(=O)N2CCC3=CC=CC=C3C2)C4CCSCC4

InChI

InChI=1S/C22H32N2OS/c25-22(24-14-9-19-3-1-2-4-20(19)17-24)6-5-18-7-12-23(13-8-18)21-10-15-26-16-11-21/h1-4,18,21H,5-17H2