3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CCC(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CCC(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=CS5)OC

InChI

InChI=1S/C27H32N4O3S/c1-33-22-18-20-8-11-31(27(24-6-5-17-35-24)21(20)19-23(22)34-2)12-9-26(32)30-15-13-29(14-16-30)25-7-3-4-10-28-25/h3-7,10,17-19,27H,8-9,11-16H2,1-2H3