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

Systemtic Name: 5-[2-(4-dimethylaminophenyl)pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile Openeye Name: 5-[2-(4-dimethylaminophenyl)-4-pyridyl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile CAS Name: 5-[2-(4-dimethylaminophenyl)-4-pyridinyl]-2-(1-piperazinyl)-1H-pyrrole-3-carbonitrile IUPAC Name: 5-[2-(4-dimethylaminophenyl)pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile Traditional Name: 5-[2-(4-dimethylaminophenyl)-4-pyridyl]-2-piperazino-1H-pyrrole-3-carbonitrile Formula: C22H24N6 MolecularWeight: 372.46616

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC=CC(=C2)C3=CC(=C(N3)N4CCNCC4)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC=CC(=C2)C3=CC(=C(N3)N4CCNCC4)C#N

InChI

InChI=1S/C22H24N6/c1-27(2)19-5-3-16(4-6-19)20-13-17(7-8-25-20)21-14-18(15-23)22(26-21)28-11-9-24-10-12-28/h3-8,13-14,24,26H,9-12H2,1-2H3