4-(1-benzofuran-2-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)-5,6,7,8-tetrahydronaphthalene-1-carbonitrile

Systemtic Name: 4-(1-benzofuran-2-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)-5,6,7,8-tetrahydronaphthalene-1-carbonitrile Openeye Name: 8-(benzofuran-2-yl)-6-[4-(2-pyridyl)piperazin-1-yl]tetralin-5-carbonitrile CAS Name: 4-(2-benzofuranyl)-2-[4-(2-pyridinyl)-1-piperazinyl]-5,6,7,8-tetrahydronaphthalene-1-carbonitrile IUPAC Name: 4-(1-benzofuran-2-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)-5,6,7,8-tetrahydronaphthalene-1-carbonitrile Traditional Name: 8-(benzofuran-2-yl)-6-[4-(2-pyridyl)piperazino]tetralin-5-carbonitrile Formula: C28H26N4O MolecularWeight: 434.53224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CC(=C2C#N)N3CCN(CC3)C4=CC=CC=N4)C5=CC6=CC=CC=C6O5

Isomeric SMILES

C1CCC2=C(C1)C(=CC(=C2C#N)N3CCN(CC3)C4=CC=CC=N4)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C28H26N4O/c29-19-24-22-9-3-2-8-21(22)23(27-17-20-7-1-4-10-26(20)33-27)18-25(24)31-13-15-32(16-14-31)28-11-5-6-12-30-28/h1,4-7,10-12,17-18H,2-3,8-9,13-16H2