6-[3-[1-(5-methylpyridin-2-yl)piperidin-4-yl]propoxy]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6-[3-[1-(5-methylpyridin-2-yl)piperidin-4-yl]propoxy]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 6-[3-[1-(5-methyl-2-pyridyl)-4-piperidyl]propoxy]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 6-[3-[1-(5-methyl-2-pyridinyl)-4-piperidinyl]propoxy]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6-[3-[1-(5-methylpyridin-2-yl)piperidin-4-yl]propoxy]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-mesyl-6-[3-[1-(5-methyl-2-pyridyl)-4-piperidyl]propoxy]-3,4-dihydro-1H-isoquinoline Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2CCC(CC2)CCCOC3=CC4=C(CN(CC4)S(=O)(=O)C)C=C3

Isomeric SMILES

CC1=CN=C(C=C1)N2CCC(CC2)CCCOC3=CC4=C(CN(CC4)S(=O)(=O)C)C=C3

InChI

InChI=1S/C24H33N3O3S/c1-19-5-8-24(25-17-19)26-12-9-20(10-13-26)4-3-15-30-23-7-6-22-18-27(31(2,28)29)14-11-21(22)16-23/h5-8,16-17,20H,3-4,9-15,18H2,1-2H3