1-(furan-2-yl)-3-(4-propanoylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-(furan-2-yl)-3-(4-propanoylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-(2-furyl)-3-(4-propanoylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-(2-furanyl)-3-[4-(1-oxopropyl)-1-piperazinyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-(furan-2-yl)-3-(4-propanoylpiperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-(2-furyl)-3-(4-propionylpiperazino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)C4=CC=CO4

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)C4=CC=CO4

InChI

InChI=1S/C21H24N4O2/c1-2-19(26)24-9-11-25(12-10-24)21-17(14-22)15-6-3-4-7-16(15)20(23-21)18-8-5-13-27-18/h5,8,13H,2-4,6-7,9-12H2,1H3