1-(furan-2-yl)-3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethanoyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-(furan-2-yl)-3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethanoyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-(2-furyl)-3-[4-[2-oxo-2-(1-piperidyl)acetyl]piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 3-[4-[1,2-dioxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]-1-(2-furanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-(furan-2-yl)-3-[4-(2-oxo-2-piperidin-1-ylacetyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-(2-furyl)-3-[4-(2-keto-2-piperidino-acetyl)piperazino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=O)N2CCN(CC2)C3=NC(=C4CCCCC4=C3C#N)C5=CC=CO5

Isomeric SMILES

C1CCN(CC1)C(=O)C(=O)N2CCN(CC2)C3=NC(=C4CCCCC4=C3C#N)C5=CC=CO5

InChI

InChI=1S/C25H29N5O3/c26-17-20-18-7-2-3-8-19(18)22(21-9-6-16-33-21)27-23(20)28-12-14-30(15-13-28)25(32)24(31)29-10-4-1-5-11-29/h6,9,16H,1-5,7-8,10-15H2