5-[2-[(E)-2-(4-fluorophenyl)ethenyl]pyridin-4-yl]-1-methyl-2-piperazin-1-yl-pyrrole-3-carbonitrile

Systemtic Name: 5-[2-[(E)-2-(4-fluorophenyl)ethenyl]pyridin-4-yl]-1-methyl-2-piperazin-1-yl-pyrrole-3-carbonitrile Openeye Name: 5-[2-[(E)-2-(4-fluorophenyl)vinyl]-4-pyridyl]-1-methyl-2-piperazin-1-yl-pyrrole-3-carbonitrile CAS Name: 5-[2-[(E)-2-(4-fluorophenyl)ethenyl]-4-pyridinyl]-1-methyl-2-(1-piperazinyl)-3-pyrrolecarbonitrile IUPAC Name: 5-[2-[(E)-2-(4-fluorophenyl)ethenyl]pyridin-4-yl]-1-methyl-2-piperazin-1-ylpyrrole-3-carbonitrile Traditional Name: 5-[2-[(E)-2-(4-fluorophenyl)vinyl]-4-pyridyl]-1-methyl-2-piperazino-pyrrole-3-carbonitrile Formula: C23H22FN5 MolecularWeight: 387.452683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1N2CCNCC2)C#N)C3=CC(=NC=C3)C=CC4=CC=C(C=C4)F

Isomeric SMILES

CN1C(=CC(=C1N2CCNCC2)C#N)C3=CC(=NC=C3)/C=C/C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN5/c1-28-22(15-19(16-25)23(28)29-12-10-26-11-13-29)18-8-9-27-21(14-18)7-4-17-2-5-20(24)6-3-17/h2-9,14-15,26H,10-13H2,1H3/b7-4+