1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-4-yl]propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-4-yl]propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]-4-piperidyl]propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[[2-(methylthio)-5-pyrimidinyl]methyl]-4-piperidinyl]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[(2-methylsulfanylpyrimidin-5-yl)methyl]piperidin-4-yl]propan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-[[2-(methylthio)pyrimidin-5-yl]methyl]-4-piperidyl]propan-1-one Formula: C23H30N4OS MolecularWeight: 410.5755

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)CN2CCC(CC2)CCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CSC1=NC=C(C=N1)CN2CCC(CC2)CCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H30N4OS/c1-29-23-24-14-19(15-25-23)16-26-11-8-18(9-12-26)6-7-22(28)27-13-10-20-4-2-3-5-21(20)17-27/h2-5,14-15,18H,6-13,16-17H2,1H3