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

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(3-methylsulfanylphenyl)methyl]piperidin-4-yl]propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(3-methylsulfanylphenyl)methyl]-4-piperidyl]propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[[3-(methylthio)phenyl]methyl]-4-piperidinyl]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(3-methylsulfanylphenyl)methyl]piperidin-4-yl]propan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[3-(methylthio)benzyl]-4-piperidyl]propan-1-one Formula: C25H32N2OS MolecularWeight: 408.59938

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)CN2CCC(CC2)CCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CSC1=CC=CC(=C1)CN2CCC(CC2)CCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H32N2OS/c1-29-24-8-4-5-21(17-24)18-26-14-11-20(12-15-26)9-10-25(28)27-16-13-22-6-2-3-7-23(22)19-27/h2-8,17,20H,9-16,18-19H2,1H3