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

Systemtic Name: 2-methylsulfonyl-6-[3-[1-(6-propylpyridazin-3-yl)piperidin-4-yl]propoxy]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-methylsulfonyl-6-[3-[1-(6-propylpyridazin-3-yl)-4-piperidyl]propoxy]-3,4-dihydro-1H-isoquinoline CAS Name: 2-methylsulfonyl-6-[3-[1-(6-propyl-3-pyridazinyl)-4-piperidinyl]propoxy]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-methylsulfonyl-6-[3-[1-(6-propylpyridazin-3-yl)piperidin-4-yl]propoxy]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-mesyl-6-[3-[1-(6-propylpyridazin-3-yl)-4-piperidyl]propoxy]-3,4-dihydro-1H-isoquinoline Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(C=C1)N2CCC(CC2)CCCOC3=CC4=C(CN(CC4)S(=O)(=O)C)C=C3

Isomeric SMILES

CCCC1=NN=C(C=C1)N2CCC(CC2)CCCOC3=CC4=C(CN(CC4)S(=O)(=O)C)C=C3

InChI

InChI=1S/C25H36N4O3S/c1-3-5-23-8-10-25(27-26-23)28-14-11-20(12-15-28)6-4-17-32-24-9-7-22-19-29(33(2,30)31)16-13-21(22)18-24/h7-10,18,20H,3-6,11-17,19H2,1-2H3