2-piperazin-1-yl-5-[2-[(E)-2-pyridin-2-ylethenyl]pyridin-4-yl]-1H-pyrrole-3-carbonitrile

Systemtic Name: 2-piperazin-1-yl-5-[2-[(E)-2-pyridin-2-ylethenyl]pyridin-4-yl]-1H-pyrrole-3-carbonitrile Openeye Name: 2-piperazin-1-yl-5-[2-[(E)-2-(2-pyridyl)vinyl]-4-pyridyl]-1H-pyrrole-3-carbonitrile CAS Name: 2-(1-piperazinyl)-5-[2-[(E)-2-(2-pyridinyl)ethenyl]-4-pyridinyl]-1H-pyrrole-3-carbonitrile IUPAC Name: 2-piperazin-1-yl-5-[2-[(E)-2-pyridin-2-ylethenyl]pyridin-4-yl]-1H-pyrrole-3-carbonitrile Traditional Name: 2-piperazino-5-[2-[(E)-2-(2-pyridyl)vinyl]-4-pyridyl]-1H-pyrrole-3-carbonitrile Formula: C21H20N6 MolecularWeight: 356.4237

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(N2)C3=CC(=NC=C3)C=CC4=CC=CC=N4)C#N

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(N2)C3=CC(=NC=C3)/C=C/C4=CC=CC=N4)C#N

InChI

InChI=1S/C21H20N6/c22-15-17-14-20(26-21(17)27-11-9-23-10-12-27)16-6-8-25-19(13-16)5-4-18-3-1-2-7-24-18/h1-8,13-14,23,26H,9-12H2/b5-4+