6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-methyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-methyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-3-(2-thienyl)-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethoxy-4-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-methyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-3-thiophen-2-yl-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-3-(2-thienyl)-3,4-dihydroisocarbostyril Formula: C28H31N3O5S MolecularWeight: 521.62784

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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=C(C=C4)OC)C5=CC=CS5

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O5S/c1-29-26(24-6-5-15-37-24)25(20-16-22(35-3)23(36-4)17-21(20)27(29)32)28(33)31-13-11-30(12-14-31)18-7-9-19(34-2)10-8-18/h5-10,15-17,25-26H,11-14H2,1-4H3