6,7-dimethoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-2-methyl-4-[4-(2-pyridyl)piperazine-1-carbonyl]-3-(2-thienyl)-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-2-methyl-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-2-methyl-4-(4-pyridin-2-ylpiperazine-1-carbonyl)-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-2-methyl-4-[4-(2-pyridyl)piperazine-1-carbonyl]-3-(2-thienyl)-3,4-dihydroisocarbostyril Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=CS5

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=CS5

InChI

InChI=1S/C26H28N4O4S/c1-28-24(21-7-6-14-35-21)23(17-15-19(33-2)20(34-3)16-18(17)25(28)31)26(32)30-12-10-29(11-13-30)22-8-4-5-9-27-22/h4-9,14-16,23-24H,10-13H2,1-3H3