2-[4-(4-phenylbut-3-yn-2-yl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-phenylbut-3-yn-2-yl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(1-methyl-3-phenyl-prop-2-ynyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-(4-phenylbut-3-yn-2-yl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-phenylbut-3-yn-2-yl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(1-methyl-3-phenyl-prop-2-ynyl)piperazino]nicotinonitrile Formula: C20H20N4 MolecularWeight: 316.3996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=CC=C1)N2CCN(CC2)C3=C(C=CC=N3)C#N

Isomeric SMILES

CC(C#CC1=CC=CC=C1)N2CCN(CC2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C20H20N4/c1-17(9-10-18-6-3-2-4-7-18)23-12-14-24(15-13-23)20-19(16-21)8-5-11-22-20/h2-8,11,17H,12-15H2,1H3